0 mol 24 unq 0 iso 0 dist 8.4051 13.2525 6.23824 12.176 6.72323 6.39466 6.7846 7.85986 10.0198 12.2839 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.4051 13.2525 6.23824 12.176 6.72323 6.39466 8.03955 4.30252 5.49281 6.22954 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.29868 4.99125 6.23824 6.66749 6.72323 6.39466 13.7992 7.85986 10.0198 12.2839 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 7.29868 4.99125 6.23824 6.66749 6.72323 6.39466 8.92779 4.30252 5.49281 6.22954 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 8.60554 11.4659 6.23824 14.012 6.72323 6.39466 13.2846 7.85986 10.0198 12.2839 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 8.60554 11.4659 6.23824 14.012 6.72323 6.39466 12.3897 4.30252 5.49281 6.22954 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.82915 12.8706 9.35279 10.4987 9.66222 18.1901 11.9949 8.04853 11.654 11.3242 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 9.82915 12.8706 9.35279 10.4987 9.66222 18.1901 13.3089 6.46549 5.1349 15.4245 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.78706 11.4024 6.90706 11.3905 7.14031 10.1557 9.53244 7.54574 6.16217 10.256 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.23884 8.43357 6.90706 14.2646 7.14031 10.1557 9.91282 7.54574 6.16217 10.256 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 5.59328 5.68803 6.90706 4.67519 7.14031 10.1557 6.54016 7.54574 6.16217 10.256 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 7.5242 5.68885 6.90706 10.4027 7.14031 10.1557 11.2206 7.54574 6.16217 10.256 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 8.65535 12.9377 9.42308 11.6598 6.1886 9.82808 12.8006 8.43182 17.4549 13.0087 numMergedOcc 0
13 mol 235 unq 0 iso 0 dist 6.36341 9.82715 5.3481 5.5163 6.94789 11.5344 4.67058 7.26232 12.2725 3.66752 numMergedOcc 0
14 mol 235 unq 1 iso 0 dist 6.21292 6.55862 5.3481 7.77516 6.94789 11.5344 10.28 7.26232 12.2725 3.66752 numMergedOcc 0
15 mol 235 unq 2 iso 0 dist 9.21736 6.8239 5.3481 11.7254 6.94789 11.5344 13.783 7.26232 12.2725 3.66752 numMergedOcc 0
16 mol 249 unq 0 iso 0 dist 5.48118 6.66935 5.72442 9.0676 5.9627 4.9236 10.3504 8.76518 13.4225 11.2713 numMergedOcc 0
17 mol 249 unq 1 iso 0 dist 7.25858 5.78976 5.72442 6.56117 5.9627 4.9236 10.9925 8.76518 13.4225 11.2713 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.83865 9.75887 6.83684 12.0136 7.16346 5.91142 9.32873 9.81919 4.24126 9.84575 numMergedOcc 0
19 mol 273 unq 1 iso 0 dist 9.18157 7.29345 6.83684 12.1851 7.16346 5.91142 5.04315 9.81919 4.24126 9.84575 numMergedOcc 0
20 mol 274 unq 0 iso 0 dist 8.52587 5.87456 5.0002 6.20558 6.88827 4.67674 12.5154 8.09181 6.71358 8.87313 numMergedOcc 0
21 mol 274 unq 1 iso 0 dist 8.52587 5.87456 5.0002 16.3619 9.16942 11.1431 12.5154 8.09181 6.71358 6.97575 numMergedOcc 0
22 mol 274 unq 2 iso 0 dist 6.39866 6.38211 5.0002 6.16703 6.88827 4.67674 4.60007 8.09181 6.71358 8.87313 numMergedOcc 0
23 mol 274 unq 3 iso 0 dist 6.39866 6.38211 5.0002 5.64601 9.16942 11.1431 4.60007 8.09181 6.71358 6.97575 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 6.89451 6.91308 5.38333 7.83813 6.95912 4.84387 4.21609 7.99204 4.88198 5.75106 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 6.89451 6.91308 5.38333 7.83813 6.95912 4.84387 4.21609 7.99204 4.88198 5.75106 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 6.89451 6.91308 5.38333 7.83813 6.95912 4.84387 4.21609 7.99204 4.88198 5.75106 numMergedOcc 0
