0 mol 7 unq 0 iso 0 dist 9.8603 13.8384 5.72491 20.3971 12.2041 7.88043 19.4516 10.5461 10.2446 8.41585 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.3237 7.88043 13.5184 12.2041 5.72491 15.637 12.2333 5.44992 7.10621 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.40051 13.0772 6.90155 17.3995 10.6808 5.81959 20.0112 12.4135 7.63409 7.31767 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.40051 13.0772 6.90155 17.3995 10.6808 5.81959 19.8215 11.6743 8.4666 6.03987 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.18305 11.4574 8.73253 11.0671 5.4148 7.04044 4.69583 6.19304 8.26458 9.96396 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.18305 11.4574 8.73253 11.0671 5.4148 7.04044 15.8603 11.6369 8.35241 9.75218 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 6.18305 11.4574 8.73253 11.0671 5.4148 7.04044 15.7901 10.2049 15.7304 9.38498 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 8.06168 9.33688 5.16364 15.4463 8.07446 8.85586 22.0317 16.0098 14.8866 8.70481 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 8.67532 13.4716 5.16364 12.1964 8.07446 8.85586 19.3492 16.0098 14.8866 8.70481 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.44385 9.79485 7.99857 5.63005 4.85907 8.56342 10.5268 10.3704 4.91132 8.73993 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 5.63005 9.79485 8.56342 8.44385 4.85907 7.99857 12.1192 12.6489 7.61939 9.87172 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 7.81337 6.99491 9.29384 10.4432 6.63273 6.92648 11.4498 6.85062 9.32969 7.12972 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 9.60369 4.02705 7.36779 9.55556 5.62899 8.20836 11.9294 11.7385 9.4027 8.94367 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 9.60369 4.02705 7.36779 9.55556 5.62899 8.20836 6.36794 11.3835 5.12325 9.86662 numMergedOcc 0
14 mol 229 unq 0 iso 0 dist 8.6537 7.78418 8.92743 5.57702 7.0298 5.77318 6.21233 11.6115 7.7339 9.87838 numMergedOcc 0
15 mol 229 unq 1 iso 0 dist 5.57702 7.78418 5.77318 8.6537 7.0298 8.92743 8.65216 11.7165 11.6847 8.22528 numMergedOcc 0
16 mol 229 unq 2 iso 0 dist 5.57702 7.78418 5.77318 8.6537 7.0298 8.92743 10.7439 11.4362 9.62106 7.03423 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 7.86368 6.83465 7.5366 12.3151 5.88703 8.24186 17.6539 12.9605 11.7705 8.34494 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 7.86368 6.83465 7.5366 12.3151 5.88703 8.24186 12.0816 9.45496 5.63086 6.56247 numMergedOcc 0
19 mol 234 unq 2 iso 0 dist 7.86368 6.83465 7.5366 12.3151 5.88703 8.24186 6.94762 6.7625 5.6819 9.36357 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 9.59174 5.79227 9.1925 10.3054 4.26007 8.15467 14.0839 10.9661 11.6066 6.97229 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 9.54857 12.7168 8.55558 9.56653 9.98105 8.59697 10.0253 11.858 7.31951 5.30224 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 6.42725 12.2782 8.59697 9.73341 9.98105 8.55558 15.0854 12.0576 5.60748 7.46176 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 8.65236 3.67304 5.26434 9.73983 7.00201 8.60026 4.49913 9.14619 6.04016 8.45658 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 9.73983 3.67304 8.60026 8.65236 7.00201 5.26434 4.49913 8.45658 6.04016 9.14619 numMergedOcc 0
