0 mol 25 unq 0 iso 0 dist 8.94828 4.54526 4.79873 10.3222 7.19007 7.21175 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.9651 4.60844 9.8703 10.0382 9.37436 9.68196 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.27307 5.29207 5.99857 9.40686 11.8246 8.42633 numMergedOcc 0
3 mol 69 unq 1 iso 0 dist 6.92837 5.29207 6.9362 9.40686 3.85648 8.42633 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 6.86713 12.4753 8.27883 16.3511 9.82384 7.64172 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.00172 7.44092 8.77023 9.82869 5.58281 5.47256 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.31276 4.72407 6.42772 9.29272 4.87167 5.35285 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 5.79157 4.72407 9.1998 9.29272 12.3235 5.35285 numMergedOcc 0
8 mol 134 unq 2 iso 0 dist 5.79157 7.97297 8.69531 9.29272 12.3235 6.71328 numMergedOcc 0
9 mol 134 unq 3 iso 0 dist 5.50687 4.72407 8.70621 9.29272 13.8191 5.35285 numMergedOcc 0
10 mol 142 unq 0 iso 0 dist 8.86346 13.5413 7.81207 11.5147 6.05056 7.80044 numMergedOcc 0
11 mol 142 unq 1 iso 0 dist 4.93681 9.85239 7.81207 7.97859 6.05056 7.80044 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.77347 8.69152 6.61112 11.8099 4.527 7.54492 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 6.18446 9.66766 9.10817 15.9884 13.1412 8.53485 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 9.96544 9.66766 6.86828 15.9884 10.444 8.53485 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 9.93754 5.30128 6.50998 9.7268 7.96183 9.12682 numMergedOcc 0
16 mol 273 unq 0 iso 0 dist 9.79022 4.3735 6.31969 8.20612 4.01113 5.3725 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.53324 10.6814 5.13913 17.6752 9.22087 9.80035 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 7.23956 10.6814 6.92711 17.6752 13.9518 9.80035 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 8.66941 8.42957 5.13913 14.4709 9.22087 9.80035 numMergedOcc 0
