0 mol 65 unq 0 iso 0 dist 8.70783 14.7151 8.9161 12.8097 8.54555 6.17 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 5.86118 5.01328 7.98453 7.75281 6.07108 10.7913 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 5.86118 5.01328 7.98453 5.72979 5.63802 10.3712 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 8.6701 7.44656 8.29506 12.4843 7.13064 6.83777 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 8.6701 4.54745 7.24843 12.4843 7.13064 10.4382 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 6.85457 7.44656 6.58492 12.4843 7.8962 6.83777 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 6.85457 4.54745 7.63783 12.4843 7.8962 10.4382 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 9.52973 5.16586 8.19198 14.2657 8.64019 9.74642 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 8.29394 9.0296 7.36361 7.04318 9.52442 11.4714 numMergedOcc 0
9 mol 123 unq 1 iso 0 dist 5.98534 6.33531 7.36361 5.76997 9.52442 11.4714 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 9.70728 12.0232 6.07708 13.8498 9.31172 5.45307 numMergedOcc 0
11 mol 192 unq 0 iso 0 dist 5.64003 4.35326 8.6938 7.33309 7.37823 10.6534 numMergedOcc 0
12 mol 192 unq 1 iso 0 dist 5.64003 4.07944 7.50854 7.33309 7.37823 11.2457 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 7.27978 10.4172 7.71806 11.9253 5.4455 12.1121 numMergedOcc 0
14 mol 278 unq 0 iso 0 dist 8.31165 4.25803 9.62872 9.05496 8.30195 11.0702 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 7.47906 5.65689 6.35591 5.35817 9.24164 10.1375 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 8.56844 5.69688 6.35591 11.6396 9.24164 10.1375 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 9.44925 12.5477 9.33975 16.5309 7.42529 13.3704 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 9.44925 12.5477 9.33975 9.0925 9.38952 16.3083 numMergedOcc 0
19 mol 280 unq 2 iso 0 dist 9.44925 5.5718 7.18775 16.5309 7.42529 14.1092 numMergedOcc 0
20 mol 280 unq 3 iso 0 dist 9.44925 5.5718 7.18775 9.0925 9.38952 11.5286 numMergedOcc 0
