0 mol 7 unq 0 iso 0 dist 7.5706 6.7985 5.82034 9.0379 6.28925 9.68596 8.43473 6.04832 6.14469 5.03847 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.5706 6.7985 5.82034 15.4949 8.70159 12.9581 8.43473 6.04832 6.14469 13.8829 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.5706 6.44736 5.28462 9.0379 6.28925 10.7018 8.43473 6.04832 9.97009 5.03847 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.5706 6.44736 5.28462 15.4949 8.70159 10.2313 8.43473 6.04832 9.97009 13.8829 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 6.28925 9.68596 5.82034 9.0379 7.5706 6.7985 5.03847 6.04832 6.14469 8.43473 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 6.28925 9.68596 5.82034 13.2247 8.70159 12.9581 5.03847 6.04832 6.14469 13.8829 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 6.79837 6.55811 9.84125 5.06358 8.07369 8.64915 5.60698 9.36902 10.6404 10.0989 numMergedOcc 0
7 mol 9 unq 1 iso 0 dist 6.79837 7.36018 6.12805 5.06358 8.07369 8.17347 5.60698 9.36902 11.7718 10.0989 numMergedOcc 0
8 mol 9 unq 2 iso 0 dist 6.79837 8.48677 7.26017 5.06358 8.07369 11.3467 5.60698 9.36902 10.9812 10.0989 numMergedOcc 0
9 mol 9 unq 3 iso 0 dist 8.07369 8.64915 9.84125 5.06358 6.79837 6.55811 10.0989 9.36902 10.6404 5.60698 numMergedOcc 0
10 mol 9 unq 4 iso 0 dist 8.07369 8.17347 6.12805 5.06358 6.79837 7.36018 10.0989 9.36902 11.7718 5.60698 numMergedOcc 0
11 mol 9 unq 5 iso 0 dist 8.07369 7.83133 6.78475 5.06358 6.79837 10.2602 10.0989 9.36902 14.8539 5.60698 numMergedOcc 0
12 mol 15 unq 0 iso 0 dist 7.876 7.48342 6.25997 5.17568 8.63502 11.2317 9.64147 7.38744 10.4058 10.7474 numMergedOcc 0
13 mol 15 unq 1 iso 0 dist 7.876 7.48342 6.25997 5.17568 8.63502 11.2317 4.29582 9.41935 6.03257 8.72342 numMergedOcc 0
14 mol 30 unq 0 iso 0 dist 5.61656 7.12365 6.10786 5.03351 8.67487 11.9646 6.10646 8.28062 11.7632 5.89021 numMergedOcc 0
15 mol 30 unq 1 iso 0 dist 5.61656 7.12365 6.10786 5.03351 8.67487 11.9646 7.0381 6.90201 11.1804 5.85054 numMergedOcc 0
16 mol 30 unq 2 iso 0 dist 5.61656 7.12365 6.10786 5.34368 6.95343 8.1284 6.10646 8.28062 11.7632 10.7121 numMergedOcc 0
17 mol 30 unq 3 iso 0 dist 5.61656 7.12365 6.10786 5.34368 6.95343 8.1284 7.0381 6.90201 11.1804 4.94076 numMergedOcc 0
18 mol 30 unq 4 iso 0 dist 6.95343 8.1284 6.10786 5.34368 5.61656 7.12365 10.7121 8.28062 11.7632 6.10646 numMergedOcc 0
19 mol 30 unq 5 iso 0 dist 6.95343 8.1284 6.10786 5.34368 5.61656 7.12365 4.94076 6.90201 11.1804 7.0381 numMergedOcc 0
20 mol 30 unq 6 iso 0 dist 6.95343 8.1284 6.10786 6.89466 8.67487 11.9646 10.7121 8.28062 11.7632 5.89021 numMergedOcc 0
21 mol 30 unq 7 iso 0 dist 6.95343 8.1284 6.10786 6.89466 8.67487 11.9646 4.94076 6.90201 11.1804 5.85054 numMergedOcc 0
22 mol 54 unq 0 iso 0 dist 9.22021 6.14538 11.3729 5.08001 7.56581 10.6808 9.96705 7.04671 13.4677 6.4484 numMergedOcc 0
23 mol 92 unq 0 iso 0 dist 7.48658 8.18107 10.5097 9.35561 7.20279 16.0825 8.70803 9.81484 15.4529 7.52639 numMergedOcc 0
24 mol 92 unq 1 iso 0 dist 7.48658 8.18107 10.5097 9.35561 7.20279 16.0825 9.52327 5.77527 13.7988 7.34683 numMergedOcc 0
25 mol 92 unq 2 iso 0 dist 7.48658 8.18107 10.5097 9.35561 7.20279 16.0825 13.093 7.313 17.7463 5.96752 numMergedOcc 0
26 mol 92 unq 3 iso 0 dist 7.48658 5.9465 6.60364 9.35561 7.20279 9.95342 8.70803 9.81484 6.77241 7.52639 numMergedOcc 0
27 mol 92 unq 4 iso 0 dist 7.48658 5.9465 6.60364 9.35561 7.20279 9.95342 9.52327 5.77527 5.50508 7.34683 numMergedOcc 0
28 mol 92 unq 5 iso 0 dist 7.48658 5.9465 6.60364 9.35561 7.20279 9.95342 13.093 7.313 11.2428 5.96752 numMergedOcc 0
29 mol 92 unq 6 iso 0 dist 7.20279 9.95342 6.60364 9.35561 7.48658 5.9465 7.52639 9.81484 6.77241 8.70803 numMergedOcc 0
30 mol 92 unq 7 iso 0 dist 7.20279 9.95342 6.60364 9.35561 7.48658 5.9465 7.34683 5.77527 5.50508 9.52327 numMergedOcc 0
31 mol 92 unq 8 iso 0 dist 7.20279 9.95342 6.60364 9.35561 7.48658 5.9465 5.96752 7.313 11.2428 13.093 numMergedOcc 0
32 mol 100 unq 0 iso 0 dist 4.5985 7.80975 4.71426 10.8586 8.20656 7.10378 6.12107 8.95014 12.71 12.5531 numMergedOcc 0
33 mol 100 unq 1 iso 0 dist 4.5985 7.80975 4.71426 10.8586 8.20656 7.10378 5.42531 6.84692 9.5057 8.4128 numMergedOcc 0
34 mol 100 unq 2 iso 0 dist 4.5985 7.80975 4.71426 10.8586 8.20656 7.10378 4.86592 5.74152 5.75014 7.96533 numMergedOcc 0
35 mol 100 unq 3 iso 0 dist 8.20656 7.10378 4.71426 10.8586 4.5985 7.80975 12.5531 8.95014 12.71 6.12107 numMergedOcc 0
36 mol 100 unq 4 iso 0 dist 8.20656 7.10378 4.71426 10.8586 4.5985 7.80975 8.4128 6.84692 9.5057 5.42531 numMergedOcc 0
37 mol 100 unq 5 iso 0 dist 8.20656 7.10378 4.71426 10.8586 4.5985 7.80975 7.96533 5.74152 5.75014 4.86592 numMergedOcc 0
38 mol 133 unq 0 iso 0 dist 9.64695 9.22232 15.8925 8.18495 4.51266 12.7901 12.538 6.49688 16.4974 4.54648 numMergedOcc 0
39 mol 133 unq 1 iso 0 dist 9.64695 9.22661 12.4336 8.18495 4.51266 13.5028 12.538 6.49688 16.5277 4.54648 numMergedOcc 0
40 mol 133 unq 2 iso 0 dist 9.64695 7.56378 9.98416 8.18495 4.51266 11.8433 12.538 6.49688 15.724 4.54648 numMergedOcc 0
41 mol 206 unq 0 iso 0 dist 4.90825 7.29285 7.77719 7.73294 5.52084 11.1799 4.51687 5.80674 10.334 4.62682 numMergedOcc 0
42 mol 206 unq 1 iso 0 dist 5.52084 6.16414 9.78738 7.73294 4.90825 13.2971 4.62682 5.80674 10.7298 4.51687 numMergedOcc 0
43 mol 206 unq 2 iso 0 dist 5.52084 7.33701 7.21306 7.73294 4.90825 12.0016 4.62682 5.80674 10.985 4.51687 numMergedOcc 0
44 mol 206 unq 3 iso 0 dist 5.52084 8.0871 4.91529 7.73294 4.90825 9.53164 4.62682 5.80674 9.9584 4.51687 numMergedOcc 0
45 mol 234 unq 0 iso 0 dist 7.72403 9.81425 10.8078 5.88703 6.35438 13.293 13.8349 9.38888 20.0705 10.0059 numMergedOcc 0
46 mol 234 unq 1 iso 0 dist 7.72403 9.81425 10.8078 15.2225 9.57132 20.0612 13.8349 9.38888 20.0705 5.08515 numMergedOcc 0
47 mol 244 unq 0 iso 0 dist 5.29811 5.50492 5.01275 8.32749 7.27258 10.7008 10.5501 7.34165 12.191 5.32505 numMergedOcc 0
48 mol 244 unq 1 iso 0 dist 5.29811 5.50492 5.01275 8.32749 7.27258 10.7008 5.17744 6.61951 6.22122 12.4021 numMergedOcc 0
