0 mol 28 unq 0 iso 0 dist 9.70195 6.44166 8.79502 9.01928 6.59687 6.68029 13.3336 6.32776 9.243 9.14653 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 8.60633 8.14607 10.8667 8.27485 13.3131 7.38868 10.0152 14.0439 3.72006 5.97363 numMergedOcc 0
2 mol 75 unq 0 iso 0 dist 9.37955 8.52499 5.04643 6.21561 9.16165 6.2449 5.72034 6.27718 3.67112 6.15203 numMergedOcc 0
3 mol 75 unq 1 iso 0 dist 9.16165 6.2449 5.04643 6.21561 9.37955 8.52499 6.15203 6.27718 3.67112 5.72034 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 9.32943 7.01146 5.21899 3.44475 8.05582 6.07433 9.79554 11.1733 11.7659 7.0847 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 8.57865 7.41599 4.36082 10.4469 10.7887 8.41086 12.5441 8.49402 6.93115 5.71964 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 8.57865 7.41599 4.36082 10.4469 10.7887 8.41086 15.7211 12.3309 10.3855 6.82156 numMergedOcc 0
7 mol 120 unq 2 iso 0 dist 9.52648 7.41599 12.2353 10.4469 18.8702 8.41086 12.5441 18.6889 6.93115 5.71964 numMergedOcc 0
8 mol 120 unq 3 iso 0 dist 9.52648 7.41599 12.2353 10.4469 18.8702 8.41086 15.7211 22.4106 10.3855 6.82156 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 6.66619 5.11863 4.84884 6.72547 10.3667 5.92785 13.1526 13.3829 9.96392 7.79858 numMergedOcc 0
10 mol 184 unq 1 iso 0 dist 6.66619 5.11863 4.84884 6.72547 10.3667 5.92785 10.3996 8.9608 5.65874 7.19946 numMergedOcc 0
11 mol 278 unq 0 iso 0 dist 7.46794 9.58671 7.41736 9.84223 10.8928 8.60481 14.0132 13.4292 7.27472 6.95272 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 9.13071 8.82948 7.26562 12.8716 10.876 5.62568 7.17626 4.70335 5.41757 7.86603 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 8.19596 8.82948 11.1391 12.8716 16.1329 5.62568 7.17626 9.38112 5.41757 7.86603 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 9.13071 8.82948 7.26562 12.8716 10.876 5.62568 7.17626 4.70335 5.41757 7.86603 numMergedOcc 0
15 mol 288 unq 1 iso 0 dist 8.19596 8.82948 11.1391 12.8716 16.1329 5.62568 7.17626 9.38112 5.41757 7.86603 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 9.13071 8.82948 7.26562 12.8716 10.876 5.62568 7.17626 4.70335 5.41757 7.86603 numMergedOcc 0
17 mol 289 unq 1 iso 0 dist 8.19596 8.82948 11.1391 12.8716 16.1329 5.62568 7.17626 9.38112 5.41757 7.86603 numMergedOcc 0
