0 mol 16 unq 0 iso 0 dist 9.76968 12.1754 7.63133 13.862 5.32694 5.46498 17.519 10.454 6.56335 6.70071 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.76968 12.1754 7.63133 19.1237 10.4155 8.71745 17.519 10.454 6.56335 4.50891 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.11056 10.4744 8.86116 14.4535 10.0952 6.86014 10.9853 5.97304 6.60423 6.00575 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.88413 5.59268 7.17969 10.5993 4.33106 7.57578 5.97432 10.1525 6.90155 9.36158 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.87281 6.17631 7.31767 7.63928 4.51512 6.03987 5.97432 7.63409 5.81959 8.4666 numMergedOcc 0
5 mol 25 unq 2 iso 0 dist 7.63928 6.17631 6.03987 9.87281 4.51512 7.31767 5.97432 8.4666 5.81959 7.63409 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.38387 11.8286 6.20293 13.3732 5.06502 5.73819 16.6874 9.06158 8.60739 5.64171 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 8.38387 11.8286 6.20293 12.9363 6.45462 8.93915 16.6874 9.06158 8.60739 11.3891 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 7.19021 9.0702 7.2846 14.4598 8.81358 7.58835 6.15568 5.73693 9.44459 11.6164 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 7.7978 6.8958 7.17396 10.3954 6.05545 9.21998 15.0717 11.0904 8.64015 12.9211 numMergedOcc 0
10 mol 59 unq 1 iso 0 dist 9.55751 5.85228 7.17396 10.7234 6.05545 9.21998 14.4867 11.0904 8.64015 12.9211 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 6.58793 9.21014 6.19965 10.7244 5.42586 7.97049 11.4371 5.08358 7.1589 6.37974 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 14.0784 10.8507 5.83991 11.9843 5.61704 5.72642 6.4497 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 9.35868 8.25001 7.30858 13.3494 11.5723 7.88312 11.9843 5.61704 5.72642 7.3094 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 5.02717 11.0268 7.88312 12.5189 7.69052 6.11741 11.1443 7.21418 5.74857 6.08806 numMergedOcc 0
15 mol 115 unq 3 iso 0 dist 4.98864 10.9437 7.88312 14.1021 11.5723 7.30858 11.2871 7.3094 5.72642 5.61704 numMergedOcc 0
16 mol 115 unq 4 iso 0 dist 4.98864 10.9437 7.88312 12.6493 8.02349 5.83991 11.2871 7.3094 5.72642 6.4497 numMergedOcc 0
17 mol 115 unq 5 iso 0 dist 7.95871 12.0354 7.88312 17.0624 11.5723 7.30858 14.361 7.3094 5.72642 5.61704 numMergedOcc 0
18 mol 115 unq 6 iso 0 dist 7.95871 12.0354 7.88312 13.7044 8.02349 5.83991 14.361 7.3094 5.72642 6.4497 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 8.07256 11.1874 6.70283 13.1529 5.42328 5.87555 16.5342 9.35627 8.28642 5.70788 numMergedOcc 0
20 mol 152 unq 1 iso 0 dist 8.07256 11.1874 6.70283 12.6103 6.4896 8.67331 16.5342 9.35627 8.28642 11.2078 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 11.3366 4.39704 7.22101 18.2547 12.9587 8.38865 11.0628 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 9.89665 11.247 7.68742 11.3361 5.79505 9.81562 16.2625 9.05842 8.50331 7.22918 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 9.89665 11.247 7.68742 14.0991 11.3368 6.27581 16.2625 9.05842 8.50331 7.00028 numMergedOcc 0
24 mol 236 unq 2 iso 0 dist 5.66569 4.15973 6.27581 12.3675 9.90963 9.81562 8.38439 7.00028 8.50331 7.22918 numMergedOcc 0
25 mol 236 unq 3 iso 0 dist 5.66569 4.15973 6.27581 11.0771 11.3368 7.68742 8.38439 7.00028 8.50331 9.05842 numMergedOcc 0
26 mol 236 unq 4 iso 0 dist 6.11137 9.01197 6.27581 14.8917 9.90963 9.81562 9.30828 7.00028 8.50331 7.22918 numMergedOcc 0
27 mol 236 unq 5 iso 0 dist 6.11137 9.01197 6.27581 15.2525 11.3368 7.68742 9.30828 7.00028 8.50331 9.05842 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 9.66555 12.2428 6.22714 11.6545 5.34096 7.31233 15.1827 10.216 5.64181 7.83352 numMergedOcc 0
29 mol 238 unq 1 iso 0 dist 8.67205 8.66185 6.22714 11.1363 5.34096 7.31233 12.1317 10.216 5.64181 7.83352 numMergedOcc 0
30 mol 272 unq 0 iso 0 dist 9.96394 11.5918 8.33638 13.3211 5.40809 8.46116 16.9819 8.7909 8.46061 4.86504 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 13.4994 6.33073 8.49997 7.65671 5.90436 9.56685 12.106 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 9.71801 5.9882 7.56915 13.4994 6.33073 8.49997 7.3996 9.27829 8.49922 12.9674 numMergedOcc 0
