0 mol 7 unq 0 iso 0 dist 8.19144 5.77391 7.31201 11.9671 10.789 7.10621 18.7757 13.6379 13.8829 8.72114 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.84459 10.3415 7.31201 16.4849 10.789 7.10621 21.2487 13.6379 13.8829 8.72114 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.41365 5.65405 5.02241 10.5929 5.06052 6.83299 5.01159 6.30987 4.29856 6.14538 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 7.37607 10.6897 6.71911 10.4837 5.33688 7.71095 9.31682 9.2902 9.64444 6.73347 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 7.49283 9.14798 5.15851 16.1633 10.0425 7.79912 15.6758 13.1026 11.4997 9.81166 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.58062 11.1785 5.81965 11.1915 6.99832 7.4729 4.665 5.39745 9.50382 6.95572 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.58062 11.1785 5.81965 11.1915 6.99832 7.4729 10.3867 10.8154 12.7565 7.38677 numMergedOcc 0
7 mol 92 unq 2 iso 0 dist 6.58062 10.8489 9.70512 11.1915 6.99832 6.82344 4.665 5.39745 7.56363 6.95572 numMergedOcc 0
8 mol 92 unq 3 iso 0 dist 6.58062 10.8489 9.70512 11.1915 6.99832 6.82344 10.3867 10.8154 5.91004 7.38677 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 9.40225 5.66289 6.27641 9.19499 7.29758 7.44554 5.02458 5.81122 5.4555 9.44367 numMergedOcc 0
10 mol 156 unq 1 iso 0 dist 9.40225 5.66289 6.27641 9.19499 7.29758 7.44554 15.8724 13.7525 11.9952 9.47433 numMergedOcc 0
11 mol 156 unq 2 iso 0 dist 9.40225 5.66289 6.27641 7.11647 8.67156 8.94056 5.02458 5.81122 5.4555 7.90267 numMergedOcc 0
12 mol 156 unq 3 iso 0 dist 7.49255 5.69897 6.27641 12.0499 7.29758 7.44554 3.98813 5.81122 5.4555 9.44367 numMergedOcc 0
13 mol 156 unq 4 iso 0 dist 7.49255 5.69897 6.27641 12.0499 7.29758 7.44554 17.4558 13.7525 11.9952 9.47433 numMergedOcc 0
14 mol 156 unq 5 iso 0 dist 7.49255 5.69897 6.27641 11.6098 8.67156 8.94056 3.98813 5.81122 5.4555 7.90267 numMergedOcc 0
15 mol 156 unq 6 iso 0 dist 4.94012 4.68187 6.27641 10.0213 7.29758 7.44554 6.29145 5.81122 5.4555 9.44367 numMergedOcc 0
16 mol 156 unq 7 iso 0 dist 4.94012 4.68187 6.27641 10.0213 7.29758 7.44554 13.8744 13.7525 11.9952 9.47433 numMergedOcc 0
17 mol 156 unq 8 iso 0 dist 4.94012 4.68187 6.27641 11.8093 8.67156 8.94056 6.29145 5.81122 5.4555 7.90267 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 7.88787 10.2898 9.6668 14.2552 8.25067 9.15386 7.23046 5.95304 9.34211 8.90963 numMergedOcc 0
19 mol 181 unq 1 iso 0 dist 9.30874 5.114 6.94688 8.90247 6.25083 9.1374 6.56225 9.06217 6.6251 6.2479 numMergedOcc 0
20 mol 181 unq 2 iso 0 dist 9.30874 5.114 6.94688 10.3907 5.86342 5.98885 8.4916 10.3766 5.6044 9.72611 numMergedOcc 0
21 mol 181 unq 3 iso 0 dist 9.30874 5.114 6.94688 10.3907 5.86342 5.98885 6.56225 9.06217 6.6251 7.99195 numMergedOcc 0
22 mol 181 unq 4 iso 0 dist 5.54873 5.114 6.71012 8.90247 4.77278 9.1374 6.56225 7.13252 6.6251 6.2479 numMergedOcc 0
23 mol 181 unq 5 iso 0 dist 5.54873 5.114 6.71012 10.3907 9.14057 5.98885 8.4916 10.7723 5.6044 9.72611 numMergedOcc 0
24 mol 181 unq 6 iso 0 dist 5.54873 5.114 6.71012 10.3907 9.14057 5.98885 6.56225 7.13252 6.6251 7.99195 numMergedOcc 0
25 mol 181 unq 7 iso 0 dist 9.7281 7.07865 7.37327 9.79901 11.1462 7.81386 10.5245 14.5372 7.20191 9.39829 numMergedOcc 0
26 mol 181 unq 8 iso 0 dist 9.7281 7.07865 7.37327 13.7928 13.3389 7.63312 12.6646 8.9289 5.63555 5.9176 numMergedOcc 0
27 mol 181 unq 9 iso 0 dist 9.7281 7.07865 7.37327 13.7928 13.3389 7.63312 10.5245 14.5372 7.20191 6.41453 numMergedOcc 0
28 mol 204 unq 0 iso 0 dist 5.37579 5.43761 5.90931 13.9155 12.9483 8.51516 9.89198 11.641 5.86489 7.32294 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 7.70781 10.6362 9.19704 6.15806 6.23291 7.26832 5.07333 10.5073 10.3603 5.44002 numMergedOcc 0
30 mol 220 unq 0 iso 0 dist 8.57161 9.20027 6.99002 17.1012 15.9568 9.23153 13.4847 13.5801 7.11498 6.59716 numMergedOcc 0
