0 mol 21 unq 0 iso 0 dist 9.19322 8.7443 13.678 14.7812 7.30688 20.7316 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 9.19322 8.7443 13.678 6.37687 6.70786 13.7852 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 9.19322 8.7443 13.678 9.29021 8.16395 17.1767 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 9.43893 8.39335 9.69493 4.94204 9.71315 12.7143 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.92929 9.86131 9.3067 7.18166 6.12663 10.2881 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 9.92929 6.75985 5.78777 7.18166 6.12663 4.62636 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.18095 9.98215 6.85215 3.94084 5.99965 8.72957 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 8.49761 6.98134 11.193 8.3164 8.33185 9.87354 numMergedOcc 0
8 mol 146 unq 0 iso 0 dist 6.70014 8.91908 14.9893 3.75935 5.50187 10.4559 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 9.1678 8.24681 6.50596 7.62254 4.89503 6.77583 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 9.94593 6.51748 6.50596 9.50276 4.89503 6.77583 numMergedOcc 0
11 mol 193 unq 0 iso 0 dist 8.30095 7.73964 14.2741 4.0847 8.44337 6.94187 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 8.73423 9.38235 13.1706 11.1412 5.81438 18.0024 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 8.73423 8.95509 5.79978 11.1412 5.81438 11.2327 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 5.51354 9.08818 10.5477 3.85734 7.9987 10.7766 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 5.51354 8.5163 6.71795 3.85734 7.9987 12.014 numMergedOcc 0
16 mol 255 unq 0 iso 0 dist 5.84157 8.66655 11.3884 4.04928 7.58813 11.4091 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 8.88518 4.98907 13.3447 9.29502 9.6327 13.5574 numMergedOcc 0
