0 mol 1 unq 0 iso 0 dist 9.44115 9.99706 7.90928 5.55519 9.78935 11.5824 numMergedOcc 0
1 mol 1 unq 0 iso 1 dist 7.90928 9.99706 9.44115 11.5824 9.78935 5.55519 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 7.78618 14.0125 8.06002 8.53993 8.51898 9.86184 numMergedOcc 0
3 mol 6 unq 0 iso 1 dist 8.06002 14.0125 7.78618 9.86184 8.51898 8.53993 numMergedOcc 0
4 mol 37 unq 0 iso 0 dist 6.69711 13.27 9.30041 13.9469 8.50293 7.05769 numMergedOcc 0
5 mol 37 unq 0 iso 1 dist 9.30041 13.27 6.69711 7.05769 8.50293 13.9469 numMergedOcc 0
6 mol 41 unq 0 iso 0 dist 8.91418 10.7739 6.0961 13.911 6.59367 6.07784 numMergedOcc 0
7 mol 41 unq 0 iso 1 dist 6.0961 10.7739 8.91418 6.07784 6.59367 13.911 numMergedOcc 0
8 mol 55 unq 0 iso 0 dist 9.12204 5.41839 9.64783 6.56327 8.37045 6.40817 numMergedOcc 0
9 mol 55 unq 0 iso 1 dist 9.64783 5.41839 9.12204 6.40817 8.37045 6.56327 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 8.17564 3.8971 7.19213 6.07398 8.10708 4.58297 numMergedOcc 0
11 mol 59 unq 0 iso 1 dist 7.19213 3.8971 8.17564 4.58297 8.10708 6.07398 numMergedOcc 0
12 mol 59 unq 1 iso 0 dist 8.17564 3.8971 7.19213 13.9662 8.42956 11.3605 numMergedOcc 0
13 mol 59 unq 1 iso 1 dist 7.19213 3.8971 8.17564 11.3605 8.42956 13.9662 numMergedOcc 0
14 mol 59 unq 2 iso 0 dist 8.17564 3.8971 7.19213 11.9466 9.20253 10.8174 numMergedOcc 0
15 mol 59 unq 2 iso 1 dist 7.19213 3.8971 8.17564 10.8174 9.20253 11.9466 numMergedOcc 0
16 mol 59 unq 3 iso 0 dist 8.17564 14.4502 6.94351 6.07398 8.10708 12.5806 numMergedOcc 0
17 mol 59 unq 3 iso 1 dist 6.94351 14.4502 8.17564 12.5806 8.10708 6.07398 numMergedOcc 0
18 mol 59 unq 4 iso 0 dist 8.17564 14.4502 6.94351 13.9662 8.42956 7.6079 numMergedOcc 0
19 mol 59 unq 4 iso 1 dist 6.94351 14.4502 8.17564 7.6079 8.42956 13.9662 numMergedOcc 0
20 mol 59 unq 5 iso 0 dist 8.17564 14.4502 6.94351 11.9466 9.20253 8.93644 numMergedOcc 0
21 mol 59 unq 5 iso 1 dist 6.94351 14.4502 8.17564 8.93644 9.20253 11.9466 numMergedOcc 0
22 mol 59 unq 3 iso 0 dist 7.19213 13.5267 6.94351 4.58297 8.10708 12.5806 numMergedOcc 0
23 mol 59 unq 3 iso 1 dist 6.94351 13.5267 7.19213 12.5806 8.10708 4.58297 numMergedOcc 0
24 mol 59 unq 4 iso 0 dist 7.19213 13.5267 6.94351 11.3605 8.42956 7.6079 numMergedOcc 0
25 mol 59 unq 4 iso 1 dist 6.94351 13.5267 7.19213 7.6079 8.42956 11.3605 numMergedOcc 0
26 mol 59 unq 5 iso 0 dist 7.19213 13.5267 6.94351 10.8174 9.20253 8.93644 numMergedOcc 0
27 mol 59 unq 5 iso 1 dist 6.94351 13.5267 7.19213 8.93644 9.20253 10.8174 numMergedOcc 0
28 mol 76 unq 0 iso 0 dist 8.39101 8.17321 6.57826 7.08972 8.84839 10.0777 numMergedOcc 0
29 mol 76 unq 0 iso 1 dist 6.57826 8.17321 8.39101 10.0777 8.84839 7.08972 numMergedOcc 0
30 mol 183 unq 0 iso 0 dist 7.42108 9.96454 9.19941 12.7618 8.57818 9.68909 numMergedOcc 0
31 mol 183 unq 0 iso 1 dist 9.19941 9.96454 7.42108 9.68909 8.57818 12.7618 numMergedOcc 0
32 mol 227 unq 0 iso 0 dist 7.77951 9.86046 8.82471 6.75917 6.20188 7.27568 numMergedOcc 0
33 mol 227 unq 0 iso 1 dist 8.82471 9.86046 7.77951 7.27568 6.20188 6.75917 numMergedOcc 0
34 mol 247 unq 0 iso 0 dist 9.76925 18.3145 9.6455 14.3657 9.70618 15.0183 numMergedOcc 0
35 mol 247 unq 0 iso 1 dist 9.6455 18.3145 9.76925 15.0183 9.70618 14.3657 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 9.20119 12.2772 8.96997 4.22263 7.10557 12.2949 numMergedOcc 0
37 mol 282 unq 0 iso 1 dist 8.96997 12.2772 9.20119 12.2949 7.10557 4.22263 numMergedOcc 0
