0 mol 12 unq 0 iso 0 dist 9.37134 8.42244 6.52451 10.2763 11.2142 7.3538 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.94824 7.28798 5.86652 5.49213 11.4912 6.82081 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.9175 9.41551 4.69243 4.38483 8.06519 8.87951 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 7.58315 9.46633 11.775 13.6455 18.7419 8.03504 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 7.58315 9.46633 11.775 11.2058 14.1398 7.87739 numMergedOcc 0
5 mol 55 unq 2 iso 0 dist 9.20445 7.15203 4.42326 5.46652 11.2223 9.34552 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 7.61972 4.93315 4.37913 7.39957 13.0894 9.60892 numMergedOcc 0
7 mol 62 unq 1 iso 0 dist 5.80956 4.93315 4.22712 7.39957 12.035 9.60892 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 8.96016 7.40481 13.6683 11.3093 13.6855 6.62952 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.96016 7.40481 13.6683 6.41542 11.4066 4.3521 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 7.03608 6.5332 4.06845 6.0128 10.8623 9.00302 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 9.13604 9.0655 7.90541 4.42019 12.1772 8.8894 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 8.66291 9.92924 7.03981 12.4493 14.613 9.23669 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 8.34798 8.87704 4.72952 4.828 9.85256 7.80073 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 7.31224 8.92649 10.4606 5.14928 4.66398 8.00841 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 5.98732 6.88579 7.85269 6.08224 9.00613 5.70674 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 7.68949 9.64956 14.3641 11.4415 13.522 9.65711 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.59505 9.53867 11.9132 14.7732 18.4017 9.24592 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.59505 9.53867 11.9132 14.7732 18.4017 9.24592 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.59505 9.53867 11.9132 14.7732 18.4017 9.24592 numMergedOcc 0
