0 mol 0 unq 0 iso 0 dist 7.31837 7.65884 8.34244 5.66453 6.64713 4.04089 9.42137 5.24778 9.23213 6.26831 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.8978 6.67398 9.57198 5.3866 8.076 6.81435 11.8248 8.50424 12.7944 7.05346 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.8978 6.67398 9.57198 10.6991 6.32226 13.6861 13.9579 6.02809 14.4698 7.9944 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 9.8978 6.67398 9.57198 10.6991 6.32226 13.6861 14.5722 4.98827 14.4218 7.032 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 6.26276 9.03359 9.57198 6.49896 8.076 6.81435 10.068 8.50424 12.7944 7.05346 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 6.26276 9.03359 9.57198 5.55187 6.32226 13.6861 10.1307 6.02809 14.4698 7.9944 numMergedOcc 0
6 mol 9 unq 5 iso 0 dist 6.26276 9.03359 9.57198 5.55187 6.32226 13.6861 10.1367 4.98827 14.4218 7.032 numMergedOcc 0
7 mol 26 unq 0 iso 0 dist 9.44507 6.77783 5.497 14.6525 9.5053 14.3325 9.7522 10.9837 13.2086 8.44506 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 5.84625 10.3974 7.6481 9.05877 6.62229 5.36808 10.3132 5.85698 10.5905 7.27383 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 5.84625 9.80755 9.11258 9.05877 6.62229 9.17656 10.3132 5.85698 6.46761 7.27383 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 5.94696 9.47873 6.0129 11.7159 8.43352 13.6622 12.3884 7.06961 10.417 7.26086 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.16592 7.62048 7.09065 15.7109 9.5669 10.2428 18.1028 9.75737 14.448 7.12017 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 8.27794 8.32999 9.83981 11.393 9.35942 8.36453 16.414 12.7083 10.6048 6.34525 numMergedOcc 0
13 mol 114 unq 1 iso 0 dist 8.27794 8.32999 9.83981 13.5888 7.42482 17.1979 11.6982 7.12268 11.9994 9.7918 numMergedOcc 0
14 mol 114 unq 2 iso 0 dist 8.27794 5.28095 6.13559 11.393 9.35942 6.22315 16.414 12.7083 11.237 6.34525 numMergedOcc 0
15 mol 114 unq 3 iso 0 dist 8.27794 5.28095 6.13559 13.5888 7.42482 13.0539 11.6982 7.12268 11.3421 9.7918 numMergedOcc 0
16 mol 114 unq 4 iso 0 dist 8.27794 11.5542 6.51395 11.393 9.35942 6.18257 16.414 12.7083 10.3172 6.34525 numMergedOcc 0
17 mol 114 unq 5 iso 0 dist 8.27794 11.5542 6.51395 13.5888 7.42482 10.4498 11.6982 7.12268 13.3175 9.7918 numMergedOcc 0
18 mol 115 unq 0 iso 0 dist 6.66022 5.46352 5.60389 5.01124 8.85881 6.03931 4.98864 5.22052 6.99777 5.74857 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 8.4733 6.02826 7.26955 6.64646 9.9151 9.0892 6.40546 7.45148 10.5042 7.99623 numMergedOcc 0
20 mol 126 unq 0 iso 0 dist 8.97111 4.56139 7.36017 5.93497 5.94233 5.83002 8.32241 6.0268 7.75534 9.46588 numMergedOcc 0
21 mol 253 unq 0 iso 0 dist 9.69704 8.75798 9.58354 9.82329 8.15091 14.5407 7.15815 5.78064 7.19465 7.77998 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 9.34004 7.73649 8.60481 5.21929 9.43042 5.04668 12.6087 6.74593 7.27505 9.69696 numMergedOcc 0
