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 C  ca nrl nc  
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 ATM3       7-JUL-05 Troullier-Martins                       
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 2s 2.00  r= 1.49/2p 2.00  r= 1.52/3d 0.00  r= 1.58/                   
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   3  0 1006  0.413125362778E-03  0.125000000000E-01   4.00000000000    
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1011
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1012
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1013
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1014
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1015
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1016
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1017
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1018
  -8.00000000000      -8.00000000000      -8.00000000000      -8.00000000000    
1019
  -8.00000000000      -8.00000000000    
1020
 Core charge follows
1021
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1022
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1023
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1024
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1025
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1026
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1027
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1028
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1029
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1030
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1031
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1032
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1033
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1034
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1035
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1036
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1037
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1038
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1039
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1040
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1041
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1042
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1043
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1044
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1045
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1046
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1047
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1048
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1049
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1050
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1051
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1052
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1053
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1054
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1055
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1056
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1057
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1058
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1059
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1060
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1061
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1062
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1063
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1064
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1065
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1066
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1067
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1068
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1069
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1070
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1071
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1072
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1073
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1074
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1075
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1076
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1077
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1078
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1079
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1080
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1081
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1082
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1083
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1084
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1085
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1086
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1087
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1088
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1089
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1090
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1091
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1092
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1093
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1094
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1095
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1096
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1097
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1098
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1099
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1100
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1101
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1102
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1103
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1104
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1105
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1106
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1107
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1108
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1109
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1110
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1111
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1112
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1113
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1114
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1115
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1116
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1117
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1118
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1119
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1120
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1121
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1122
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1123
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1124
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1125
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1126
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1127
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1128
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1129
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1130
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1131
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1132
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1133
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1134
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1135
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1136
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1137
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1138
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1139
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1140
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1141
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1142
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1143
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1144
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1145
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1146
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1147
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1148
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1149
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1150
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1151
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1152
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1153
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1154
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1155
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1156
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1157
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1158
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1159
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1160
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1161
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1162
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1163
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1164
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1165
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1166
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1167
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1168
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1169
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1170
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1171
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1172
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1173
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1174
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1175
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1176
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1177
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1178
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1179
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1180
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1181
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1182
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1183
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1184
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1185
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1186
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1187
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1188
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1189
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1190
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1191
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1192
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1193
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1194
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1195
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1196
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1197
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1198
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1199
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1200
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1201
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1202
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1203
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1204
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1205
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1206
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1207
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1208
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1209
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1210
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1211
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1212
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1213
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1214
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1215
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1216
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1217
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1218
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1219
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1220
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1221
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1222
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1223
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1224
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1225
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1226
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1227
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1228
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1229
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1230
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1231
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1232
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1233
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1234
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1235
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1236
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1237
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1238
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1239
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1240
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1241
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1242
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1243
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1244
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1245
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1246
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1247
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1248
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1249
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1250
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1251
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1252
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1253
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1254
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1255
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1256
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1257
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1258
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1259
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1260
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1261
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1262
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1263
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1264
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1265
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1266
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1267
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1268
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1269
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1270
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1271
   0.00000000000       0.00000000000       0.00000000000       0.00000000000    
1272
   0.00000000000       0.00000000000    
1273
 Valence charge follows
1274
  0.291297486688E-10  0.117989232142E-09  0.268832548114E-09  0.483980190891E-09
1275
  0.765820849654E-09  0.111681325373E-08  0.153948806605E-08  0.203644982611E-08
1276
  0.261037894359E-08  0.326403374402E-08  0.400025256783E-08  0.482195592411E-08
1277
  0.573214870051E-08  0.673392243070E-08  0.783045762092E-08  0.902502613712E-08
1278
  0.103209936541E-07  0.117218221686E-07  0.132310725775E-07  0.148524073233E-07
1279
  0.165895931080E-07  0.184465036779E-07  0.204271226805E-07  0.225355465958E-07
1280
  0.247759877429E-07  0.271527773660E-07  0.296703687991E-07  0.323333407136E-07
1281
  0.351464004497E-07  0.381143874345E-07  0.412422766878E-07  0.445351824200E-07
1282
  0.479983617222E-07  0.516372183520E-07  0.554573066173E-07  0.594643353611E-07
1283
  0.636641720482E-07  0.680628469588E-07  0.726665574898E-07  0.774816725674E-07
1284
  0.825147371738E-07  0.877724769905E-07  0.932618031623E-07  0.989898171831E-07
1285
  0.104963815909E-06  0.111191296700E-06  0.117679962694E-06  0.124437728219E-06
1286
  0.131472724342E-06  0.138793304561E-06  0.146408050647E-06  0.154325778635E-06
1287
  0.162555544966E-06  0.171106652792E-06  0.179988658441E-06  0.189211378048E-06
1288
  0.198784894360E-06  0.208719563708E-06  0.219026023173E-06  0.229715197917E-06
1289
  0.240798308722E-06  0.252286879708E-06  0.264192746256E-06  0.276528063137E-06
1290
  0.289305312844E-06  0.302537314142E-06  0.316237230836E-06  0.330418580764E-06
1291
  0.345095245023E-06  0.360281477433E-06  0.375991914235E-06  0.392241584052E-06
1292
  0.409045918093E-06  0.426420760625E-06  0.444382379717E-06  0.462947478249E-06
1293
  0.482133205214E-06  0.501957167303E-06  0.522437440792E-06  0.543592583731E-06
1294
  0.565441648443E-06  0.588004194349E-06  0.611300301118E-06  0.635350582157E-06
1295
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1402
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1403
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1404
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1405
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1407
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1408
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1409
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1410
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1411
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1412
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1413
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1414
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1415
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1416
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1417
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1418
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1419
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1420
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1421
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1422
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1423
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1424
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1425
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1426
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1427
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1428
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1429
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1430
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1431
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1432
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1433
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1434
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1435
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1436
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1437
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1438
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1439
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1440
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1441
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1442
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1443
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1444
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1445
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1446
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1447
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1448
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1449
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1451
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1455
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1456
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1469
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1500
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1508
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1509
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1510
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1511
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1512
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1513
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1520
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1521
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1522
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1523
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1524
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1525
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