0 mol 24 unq 0 iso 0 dist 7.40392 8.56483 5.59311 8.23069 5.54419 8.70827 5.089 10.3343 9.65191 12.8297 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.40392 8.56483 5.59311 8.59466 7.36323 9.12854 5.089 10.3343 9.65191 7.93303 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 9.53239 7.97049 9.82915 6.14753 10.7029 5.79841 13.8798 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 9.9795 5.20528 9.29301 13.0232 6.19965 12.0078 6.14753 10.7029 5.79841 15.5426 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 8.86938 8.65004 11.8396 4.9102 7.71338 11.5768 11.2572 18.957 9.75656 15.4167 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 8.86938 9.86487 18.0868 4.9102 7.71338 12.9739 15.6815 24.0782 9.69961 16.9699 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 7.5055 8.91143 5.81428 10.9541 8.22656 13.5737 7.43569 9.4473 5.80404 15.4455 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 7.5055 8.91143 5.81428 5.61003 6.82262 10.9779 7.43569 9.4473 5.80404 11.1611 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 8.27794 6.02094 10.2585 4.89429 9.09537 9.85106 9.24302 15.0674 5.67112 11.6133 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 6.11505 6.79634 11.6232 9.35174 9.61492 15.8388 5.03046 8.43584 6.05667 12.4616 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 6.11505 6.79634 11.6232 11.3225 7.45763 16.0523 5.03046 8.43584 6.05667 10.6123 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 9.43611 6.90717 7.8472 11.2069 8.82096 11.9912 5.26468 13.2093 7.43301 15.6422 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 6.45574 4.46919 7.60081 6.70342 5.4638 9.55668 5.71985 11.5033 6.20377 12.3562 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 8.49415 7.87337 13.6299 4.05162 8.4218 9.58094 9.6551 13.4214 7.49913 7.8929 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.13226 6.74022 5.29529 10.7073 7.56915 8.52587 9.7346 12.0331 9.02661 17.306 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 9.13226 6.74022 5.29529 11.3302 8.49997 11.6126 9.7346 12.0331 9.02661 18.7379 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 7.23956 6.71956 7.70529 15.6875 9.7748 16.795 7.09461 6.90434 5.92532 13.2927 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 9.91518 6.9592 14.3412 12.8387 8.44326 18.2538 5.49004 9.82774 8.20933 10.5903 numMergedOcc 0
