0 mol 66 unq 0 iso 0 dist 7.03034 5.25191 8.95789 3.27867 9.28525 6.86331 numMergedOcc 0
1 mol 66 unq 1 iso 0 dist 7.03034 5.25191 8.95789 5.62244 8.55807 9.37607 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.44753 9.5091 7.09393 8.15075 9.24557 11.5139 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 8.44753 6.88345 3.87167 8.15075 9.24557 8.73219 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 9.52282 11.2351 6.60356 9.66322 7.52622 6.1312 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 7.82151 9.05726 9.95726 6.22194 9.20544 13.1021 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 7.76707 8.37794 9.86842 12.9119 8.74958 12.8839 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 7.63425 12.9585 9.86842 11.7966 8.74958 12.8839 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 5.86949 6.33907 9.71692 9.5045 8.21863 7.81081 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 6.72591 7.50382 9.71692 4.44134 8.21863 7.81081 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 5.84971 6.43607 9.73708 9.37167 8.16324 7.57411 numMergedOcc 0
11 mol 150 unq 1 iso 0 dist 6.80192 7.48524 9.73708 4.36797 8.16324 7.57411 numMergedOcc 0
12 mol 158 unq 0 iso 0 dist 8.34722 6.26228 7.07348 7.11584 7.41387 6.86194 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 9.0757 16.3549 9.45847 10.1333 5.67457 12.5274 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 9.0757 6.55123 7.895 10.1333 5.67457 8.33714 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 9.39563 3.95306 9.45847 10.859 5.67457 12.5274 numMergedOcc 0
16 mol 184 unq 3 iso 0 dist 9.39563 17.0877 7.895 10.859 5.67457 8.33714 numMergedOcc 0
17 mol 184 unq 4 iso 0 dist 7.51045 9.14602 9.45847 5.33924 5.67457 12.5274 numMergedOcc 0
18 mol 184 unq 5 iso 0 dist 7.51045 13.1965 7.895 5.33924 5.67457 8.33714 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.98221 13.6469 9.08767 9.04255 7.62128 14.8895 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 7.66083 12.5945 7.57712 8.81855 6.57898 5.80442 numMergedOcc 0
21 mol 220 unq 1 iso 0 dist 7.66083 8.9471 7.20255 8.81855 6.57898 6.80972 numMergedOcc 0
22 mol 245 unq 0 iso 0 dist 7.1207 5.75694 7.26913 8.22034 9.99553 8.4059 numMergedOcc 0
23 mol 245 unq 1 iso 0 dist 7.1207 6.87827 6.41862 8.22034 9.99553 10.2813 numMergedOcc 0
24 mol 245 unq 2 iso 0 dist 7.1207 9.93908 8.69377 8.22034 9.99553 7.4192 numMergedOcc 0
25 mol 254 unq 0 iso 0 dist 9.26382 12.2374 7.53352 4.77142 8.5291 12.5167 numMergedOcc 0
26 mol 254 unq 1 iso 0 dist 9.26382 12.2374 7.53352 8.61804 9.32852 16.0777 numMergedOcc 0
27 mol 254 unq 2 iso 0 dist 9.26382 8.99253 7.80793 4.77142 8.5291 8.03226 numMergedOcc 0
28 mol 254 unq 3 iso 0 dist 9.26382 8.99253 7.80793 8.61804 9.32852 13.263 numMergedOcc 0
29 mol 254 unq 4 iso 0 dist 9.73281 14.9316 7.53352 7.84649 8.5291 12.5167 numMergedOcc 0
30 mol 254 unq 5 iso 0 dist 9.73281 14.9316 7.53352 6.71193 9.32852 16.0777 numMergedOcc 0
31 mol 254 unq 6 iso 0 dist 9.73281 13.1153 7.80793 7.84649 8.5291 8.03226 numMergedOcc 0
32 mol 254 unq 7 iso 0 dist 9.73281 13.1153 7.80793 6.71193 9.32852 13.263 numMergedOcc 0
