0 mol 17 unq 0 iso 0 dist 8.58468 9.83791 13.7814 9.26114 7.34681 17.193 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.58468 7.95007 11.1609 9.26114 7.34681 12.5763 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.25196 8.88159 5.58256 6.39129 8.16246 9.48823 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 8.88159 6.25196 5.58256 6.39129 9.48823 8.16246 numMergedOcc 0
4 mol 116 unq 0 iso 0 dist 5.58346 7.09179 4.48374 8.38134 6.53824 6.61973 numMergedOcc 0
5 mol 116 unq 1 iso 0 dist 7.09179 5.58346 4.48374 8.38134 6.61973 6.53824 numMergedOcc 0
6 mol 116 unq 2 iso 0 dist 6.24768 9.31875 4.48374 5.88698 6.53824 6.61973 numMergedOcc 0
7 mol 116 unq 3 iso 0 dist 9.31875 6.24768 4.48374 5.88698 6.61973 6.53824 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 9.16949 8.65294 5.17212 11.7651 9.13339 11.3016 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 9.16949 8.65294 5.17212 5.14081 7.60956 9.9171 numMergedOcc 0
10 mol 140 unq 2 iso 0 dist 8.65294 9.16949 5.17212 5.14081 9.9171 7.60956 numMergedOcc 0
11 mol 157 unq 0 iso 0 dist 6.97303 9.46764 10.9215 6.72897 6.8976 10.6584 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 8.22495 8.39603 5.77399 10.0544 8.29364 8.97652 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 8.39603 8.22495 5.77399 10.0544 8.97652 8.29364 numMergedOcc 0
14 mol 243 unq 0 iso 0 dist 4.88105 9.01318 5.57083 4.7112 4.64178 10.0377 numMergedOcc 0
15 mol 243 unq 1 iso 0 dist 4.88105 9.01318 5.57083 9.56957 9.16988 11.6162 numMergedOcc 0
16 mol 255 unq 0 iso 0 dist 5.53395 6.94032 9.12886 5.96376 9.40767 10.477 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 7.87577 5.86702 5.31174 4.69752 8.10903 7.25618 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 5.86702 7.87577 5.31174 4.18036 8.70193 11.866 numMergedOcc 0
19 mol 258 unq 2 iso 0 dist 5.86702 7.87577 5.31174 4.69752 7.25618 8.10903 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 8.65743 8.02607 5.6921 5.36882 9.62494 10.0796 numMergedOcc 0
21 mol 274 unq 0 iso 0 dist 8.95153 7.1255 5.85211 7.77559 9.34051 12.0112 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 9.87771 9.10723 9.67016 15.2194 7.83793 16.9361 numMergedOcc 0
