0 mol 1 unq 0 iso 0 dist 7.59404 6.06669 5.55519 9.60615 5.21705 7.28542 13.5153 13.4579 8.69605 12.6842 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.38662 8.83248 6.95983 9.4658 4.89928 7.20713 10.3387 9.76585 8.84944 6.57633 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 8.58853 5.75102 4.29097 5.21993 8.22454 7.82219 12.2856 12.1922 8.92529 15.9398 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 8.60361 5.72494 11.1242 9.43076 11.4521 4.78648 5.40051 13.979 7.66418 12.2218 numMergedOcc 0
4 mol 103 unq 1 iso 0 dist 8.60361 8.70106 15.0192 9.43076 11.4521 10.6434 5.40051 13.979 8.078 12.2218 numMergedOcc 0
5 mol 103 unq 2 iso 0 dist 8.60361 8.70106 15.0192 9.43076 11.4521 10.6434 14.0531 20.6883 6.56481 17.0972 numMergedOcc 0
6 mol 122 unq 0 iso 0 dist 4.38961 6.78551 6.25432 7.34585 3.65582 9.61656 11.7558 13.8174 8.9864 17.3913 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 8.6499 8.60157 14.6035 9.8506 13.5761 16.0449 6.76353 13.508 8.6953 15.4666 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 8.6499 6.72591 14.778 9.8506 13.5761 8.01366 6.76353 13.508 9.18753 15.4666 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 8.75339 8.59359 14.6751 9.91991 13.6344 16.1293 6.65519 13.5808 8.65967 15.4042 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 8.75339 6.80192 14.922 9.91991 13.6344 8.04136 6.65519 13.5808 9.15244 15.4042 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.8024 6.6514 11.1988 5.57495 11.8945 8.23378 8.3419 11.8028 7.20545 13.1213 numMergedOcc 0
12 mol 167 unq 1 iso 0 dist 9.8024 6.6514 11.1988 9.38297 18.1675 12.2546 8.3419 11.8028 7.20545 16.1368 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 6.22499 9.66533 9.18058 8.70011 9.75492 10.0389 13.587 12.2006 4.36421 14.1246 numMergedOcc 0
14 mol 259 unq 0 iso 0 dist 6.37648 9.49732 10.1526 7.8428 4.83781 6.51653 14.4507 17.5626 8.54422 14.031 numMergedOcc 0
15 mol 259 unq 1 iso 0 dist 6.37648 9.49732 10.1526 7.8428 4.83781 6.51653 10.4459 14.7663 7.67473 12.3498 numMergedOcc 0
