0 mol 26 unq 0 iso 0 dist 7.89222 6.29981 6.07276 11.3643 5.30297 6.73167 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.32127 4.56199 6.7142 9.32113 5.45023 7.90721 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 8.04708 8.13434 8.20298 6.50983 5.14532 7.99016 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 8.04708 9.18004 6.13351 6.50983 5.14532 6.41793 numMergedOcc 0
4 mol 105 unq 0 iso 0 dist 8.60172 10.5216 7.77089 12.3526 4.22355 7.44838 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 6.73172 7.35282 8.72725 12.1921 15.0784 7.44041 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 9.45931 11.3431 9.27009 9.83827 12.612 6.99125 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 6.49728 14.123 9.27009 18.7719 12.612 6.99125 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 6.35397 12.017 6.65731 6.78772 5.38571 6.77921 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 9.58371 10.8566 9.97968 14.3843 10.8263 6.11331 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 7.13199 3.96267 9.97968 8.15524 10.8263 6.11331 numMergedOcc 0
11 mol 159 unq 0 iso 0 dist 8.65596 9.89725 9.35202 13.0443 7.97232 6.07821 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.38735 9.90173 6.88127 10.7352 6.16503 8.31881 numMergedOcc 0
13 mol 188 unq 0 iso 0 dist 7.47937 6.96531 8.66624 10.2019 5.0782 7.79115 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 8.51408 5.74211 6.22742 10.0764 6.0634 6.34234 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 5.87056 10.8814 9.18728 13.1731 12.8075 9.43618 numMergedOcc 0
16 mol 227 unq 1 iso 0 dist 9.84311 10.8814 8.91971 13.1731 4.59123 9.43618 numMergedOcc 0
17 mol 227 unq 2 iso 0 dist 9.55881 15.3045 9.18728 19.9664 12.8075 9.43618 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 7.37358 9.64562 9.42255 12.4427 15.1378 7.37478 numMergedOcc 0
