0 mol 5 unq 0 iso 0 dist 9.89833 9.83318 4.2849 3.99762 9.65106 8.97274 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.3489 7.74463 5.04413 5.92541 6.77277 7.82875 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.25984 9.04117 5.5061 4.22382 5.51659 6.57633 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 7.61631 7.95291 5.1165 6.26938 8.50926 11.8311 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 7.25133 9.93116 13.7243 11.2933 9.55276 20.0268 numMergedOcc 0
5 mol 152 unq 0 iso 0 dist 9.57285 9.21757 5.46646 4.57152 6.89622 7.94976 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 9.47945 9.67711 12.6471 6.8538 8.95953 10.8482 numMergedOcc 0
7 mol 182 unq 0 iso 0 dist 8.94671 8.8774 4.82437 9.4786 8.63031 12.4766 numMergedOcc 0
8 mol 224 unq 0 iso 0 dist 7.47122 8.57781 3.56689 12.0975 8.65729 8.565 numMergedOcc 0
9 mol 224 unq 1 iso 0 dist 6.6537 5.36326 3.56689 3.74681 8.65729 8.565 numMergedOcc 0
10 mol 224 unq 2 iso 0 dist 9.08719 5.36326 11.4272 3.74681 9.9137 8.565 numMergedOcc 0
11 mol 230 unq 0 iso 0 dist 6.23346 9.3974 12.4865 5.70986 8.59955 6.75627 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 7.21466 5.99355 11.8914 6.18958 8.39251 10.1042 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 8.91916 8.40328 10.2743 6.49658 9.06386 9.51375 numMergedOcc 0
14 mol 259 unq 1 iso 0 dist 8.91916 8.2518 11.46 6.49658 9.06386 11.5486 numMergedOcc 0
15 mol 259 unq 2 iso 0 dist 4.55368 8.40328 7.06301 6.49658 6.66413 9.51375 numMergedOcc 0
16 mol 259 unq 3 iso 0 dist 4.55368 8.2518 7.80863 6.49658 6.66413 11.5486 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 6.58277 8.95841 11.8531 5.46443 9.64978 13.8894 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 8.42706 8.62843 11.8531 11.4451 9.64978 13.8894 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 8.57035 7.03656 7.23238 7.77606 7.08788 8.30375 numMergedOcc 0
