0 mol 9 unq 0 iso 0 dist 8.57077 6.85412 8.27962 10.6533 7.38017 12.3513 5.60154 8.47421 9.29529 6.21879 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.57077 6.33889 11.4878 10.6533 7.38017 12.218 5.60154 8.47421 7.2199 6.21879 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.57077 6.33889 11.4878 10.6533 7.38017 12.218 4.61049 12.6047 6.9513 12.3796 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.57077 6.33889 11.4878 10.6533 7.38017 12.218 6.64015 14.9473 9.16116 16.9721 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 8.57077 6.33889 11.4878 10.6533 7.38017 12.218 13.7377 16.8226 8.47109 13.9992 numMergedOcc 0
5 mol 15 unq 0 iso 0 dist 6.82505 7.12903 5.51916 4.13564 7.88714 10.4006 5.55659 9.78051 8.96967 6.93503 numMergedOcc 0
6 mol 45 unq 0 iso 0 dist 6.43774 7.06308 4.71384 4.11544 7.742 9.32294 9.01651 12.1257 8.59109 10.7029 numMergedOcc 0
7 mol 45 unq 1 iso 0 dist 7.2846 6.34173 4.71384 4.91588 7.742 9.32294 6.89191 12.1257 8.59109 10.7029 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.96708 7.321 9.0131 11.8198 4.69674 12.7304 7.11552 6.77912 9.19459 9.58779 numMergedOcc 0
9 mol 72 unq 1 iso 0 dist 9.96708 7.321 9.0131 11.8198 4.69674 12.7304 7.17489 10.4676 8.59747 13.8837 numMergedOcc 0
10 mol 88 unq 0 iso 0 dist 9.36773 8.66514 8.4283 11.9839 9.54952 16.5629 5.90098 9.15979 7.71582 14.5306 numMergedOcc 0
11 mol 88 unq 1 iso 0 dist 9.36773 9.25235 5.37521 11.9839 9.54952 14.3833 5.90098 9.15979 6.65776 14.5306 numMergedOcc 0
12 mol 114 unq 0 iso 0 dist 7.35754 7.52743 4.77056 3.9247 8.06359 9.18917 5.33327 8.68821 7.36816 4.62296 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 9.30299 9.81878 4.77464 12.4721 8.82676 13.4764 14.085 8.59981 6.3244 16.7971 numMergedOcc 0
14 mol 155 unq 0 iso 0 dist 6.43582 9.14392 12.1814 4.47054 6.89245 13.3925 6.3437 12.2465 6.51096 9.94582 numMergedOcc 0
15 mol 155 unq 1 iso 0 dist 6.43582 9.14392 12.1814 4.47054 6.89245 13.3925 9.99927 15.1841 8.73171 13.7903 numMergedOcc 0
16 mol 155 unq 2 iso 0 dist 6.43582 7.51198 6.34186 4.47054 6.89245 10.9101 8.27726 7.36102 7.37901 9.97388 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 6.61986 8.19953 10.7113 4.32714 7.80754 12.4783 7.67202 12.6391 4.55996 11.5536 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 6.61986 8.19953 10.7113 8.95149 8.20295 16.1425 7.67202 12.6391 4.55996 16.3783 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 7.09863 8.17891 9.13836 6.16261 6.40086 12.6208 13.3557 16.1617 7.95168 19.134 numMergedOcc 0
