0 mol 41 unq 0 iso 0 dist 6.51139 8.0072 9.28138 10.8697 6.75602 15.8399 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.14072 5.41774 4.55422 9.90363 5.06188 7.78899 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 9.09831 9.33236 6.98415 6.76039 6.70095 9.73556 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 7.41861 6.63973 6.1999 7.7047 5.73235 6.14248 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 7.41861 6.63973 6.1999 4.00834 7.48127 6.97936 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 5.55798 8.59739 5.71097 7.95422 8.61089 13.9889 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 5.55798 8.59739 5.71097 6.05149 8.64686 9.90428 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.73946 6.31773 5.34438 4.75292 9.33293 10.4336 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 5.16531 6.53559 9.54936 12.2874 9.52061 16.2371 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 5.16531 7.90844 9.63929 12.2874 9.52061 18.9029 numMergedOcc 0
10 mol 129 unq 2 iso 0 dist 6.65878 8.09774 6.31483 5.0466 7.6453 8.85652 numMergedOcc 0
11 mol 139 unq 0 iso 0 dist 9.71665 7.02063 3.82037 5.61614 9.70154 6.79625 numMergedOcc 0
12 mol 139 unq 1 iso 0 dist 9.71665 7.02063 3.82037 4.94393 8.78382 7.20542 numMergedOcc 0
13 mol 192 unq 0 iso 0 dist 5.21088 7.93715 6.62595 4.65303 7.36571 5.77035 numMergedOcc 0
14 mol 192 unq 1 iso 0 dist 9.78743 7.93715 13.2141 13.2525 6.2016 18.7047 numMergedOcc 0
15 mol 192 unq 2 iso 0 dist 8.25609 7.93715 12.1003 4.65303 9.17137 5.77035 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 9.35664 9.48766 6.04748 10.612 7.2833 10.6324 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.47833 6.41148 10.1222 11.2438 6.43519 10.2097 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 5.47586 5.06713 10.1222 7.47443 6.43519 10.2097 numMergedOcc 0
19 mol 205 unq 2 iso 0 dist 5.47586 8.69512 10.4922 7.47443 6.43519 5.63283 numMergedOcc 0
20 mol 226 unq 0 iso 0 dist 9.03261 9.71835 7.37944 9.96567 8.74399 14.1784 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 5.19913 8.98005 5.84974 6.28086 9.24729 11.2895 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 8.01777 8.7831 12.6648 12.4724 6.9103 18.7387 numMergedOcc 0
23 mol 233 unq 1 iso 0 dist 8.01777 9.61071 13.8023 12.4724 6.9103 20.2512 numMergedOcc 0
24 mol 233 unq 2 iso 0 dist 8.01777 7.1229 8.98854 12.4724 6.9103 15.4752 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 4.53228 7.96523 7.26668 10.9464 8.26312 11.4569 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 4.53228 7.96523 7.26668 6.54316 7.58554 7.98794 numMergedOcc 0
27 mol 273 unq 0 iso 0 dist 6.91029 8.89714 9.23419 5.64983 6.02879 11.2987 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 7.38536 8.69325 10.5146 6.37482 6.32984 11.0455 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 7.38536 5.09181 4.4744 6.37482 6.32984 6.24134 numMergedOcc 0
