0 mol 43 unq 0 iso 0 dist 9.16827 10.4149 6.75943 18.3894 12.2906 8.21247 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.28737 15.5785 9.85905 19.8558 14.1154 9.73179 numMergedOcc 0
2 mol 132 unq 0 iso 0 dist 9.0339 3.48657 6.89918 8.58873 5.28089 8.40461 numMergedOcc 0
3 mol 132 unq 1 iso 0 dist 8.48641 3.48657 7.89457 8.58873 4.50065 8.40461 numMergedOcc 0
4 mol 167 unq 0 iso 0 dist 9.73922 6.35125 7.68266 7.35339 5.74656 9.47168 numMergedOcc 0
5 mol 167 unq 1 iso 0 dist 9.73922 8.80332 6.84752 7.35339 5.74656 9.76579 numMergedOcc 0
6 mol 167 unq 2 iso 0 dist 6.64164 12.0503 9.2289 9.52659 6.67469 9.47168 numMergedOcc 0
7 mol 167 unq 3 iso 0 dist 6.64164 10.1276 7.02548 9.52659 6.67469 9.76579 numMergedOcc 0
8 mol 168 unq 0 iso 0 dist 6.60477 6.54174 6.02086 10.2365 10.9775 5.51167 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.63906 7.80781 7.2793 10.3531 5.5366 6.84679 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 6.22696 13.0947 9.10817 11.5852 7.17757 7.86042 numMergedOcc 0
11 mol 222 unq 0 iso 0 dist 7.14277 5.85969 5.56538 11.2654 9.84386 7.99441 numMergedOcc 0
12 mol 222 unq 1 iso 0 dist 7.14277 9.34147 7.48954 11.2654 9.84386 6.71817 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 7.13194 13.1414 9.72188 12.7015 7.04671 5.52788 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 7.80166 6.10342 9.72188 8.66923 7.04671 5.52788 numMergedOcc 0
15 mol 292 unq 0 iso 0 dist 5.69465 4.54051 7.20674 13.4176 16.264 9.63325 numMergedOcc 0
16 mol 292 unq 1 iso 0 dist 5.69465 5.92893 8.38121 12.7197 11.5813 9.64781 numMergedOcc 0
