0 mol 28 unq 0 iso 0 dist 8.24422 8.99724 5.89728 5.75809 8.89273 8.10455 10.5266 9.05939 9.38747 14.2352 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.99724 8.24422 5.89728 5.75809 8.10455 8.89273 10.5266 9.38747 9.05939 14.2352 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 5.45684 7.66372 4.78627 9.05343 7.81738 5.92555 5.8441 7.76644 9.99743 7.71528 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 7.76644 9.99743 4.78627 7.71528 7.81738 5.92555 5.8441 5.45684 7.66372 9.05343 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 7.66372 5.45684 4.78627 9.05343 5.92555 7.81738 5.8441 9.99743 7.76644 7.71528 numMergedOcc 0
5 mol 64 unq 3 iso 0 dist 9.99743 7.76644 4.78627 7.71528 5.92555 7.81738 5.8441 7.66372 5.45684 9.05343 numMergedOcc 0
6 mol 96 unq 0 iso 0 dist 9.579 9.06717 6.20878 7.68964 9.9118 9.28941 6.42012 7.96523 11.2264 11.2697 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.62952 7.88143 8.21408 8.73798 8.734 13.2666 5.4823 4.3521 10.5625 5.24616 numMergedOcc 0
8 mol 151 unq 0 iso 0 dist 5.89468 7.93343 4.78271 8.16646 10.4799 8.30893 8.30648 9.79321 10.3029 12.947 numMergedOcc 0
9 mol 172 unq 0 iso 0 dist 5.28889 4.90175 10.1227 7.3485 9.6831 7.16279 5.65773 7.44084 7.77643 10.1211 numMergedOcc 0
10 mol 172 unq 1 iso 0 dist 4.90175 5.28889 10.1227 7.3485 7.16279 9.6831 5.65773 7.77643 7.44084 10.1211 numMergedOcc 0
11 mol 209 unq 0 iso 0 dist 6.74526 8.12326 5.00665 9.81506 4.19179 6.28791 5.1282 8.68691 7.37014 10.1748 numMergedOcc 0
12 mol 209 unq 1 iso 0 dist 8.12326 6.74526 5.00665 9.81506 6.28791 4.19179 5.1282 7.37014 8.68691 10.1748 numMergedOcc 0
13 mol 209 unq 2 iso 0 dist 8.12326 6.74526 5.00665 9.81506 6.28791 4.19179 9.5473 8.20431 11.8578 13.1043 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 5.84467 8.56533 8.60638 8.09613 4.11753 12.5011 6.60063 9.30394 8.5458 11.068 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 8.56533 5.84467 8.60638 8.09613 12.5011 4.11753 6.60063 8.5458 9.30394 11.068 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 5.84467 8.56533 8.60638 8.09613 4.11753 12.5011 6.60063 9.30394 8.5458 11.068 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 8.56533 5.84467 8.60638 8.09613 12.5011 4.11753 6.60063 8.5458 9.30394 11.068 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 5.84467 8.56533 8.60638 8.09613 4.11753 12.5011 6.60063 9.30394 8.5458 11.068 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 8.56533 5.84467 8.60638 8.09613 12.5011 4.11753 6.60063 8.5458 9.30394 11.068 numMergedOcc 0
