0 mol 34 unq 0 iso 0 dist 4.97286 7.66913 7.072 5.39587 9.9482 9.12176 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 4.97286 7.66913 7.072 6.47252 3.92518 9.21138 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 8.14175 8.4436 9.82078 6.17708 7.13642 3.91611 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 6.38956 8.4436 6.8989 6.17708 5.88717 3.91611 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.99047 6.27321 9.60291 6.72469 6.50041 7.71726 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.23686 9.71247 5.03009 7.21134 3.77519 5.1678 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 8.23686 4.95459 10.8746 7.21134 3.77519 11.1059 numMergedOcc 0
7 mol 69 unq 2 iso 0 dist 9.38571 9.71247 13.87 7.21134 14.5169 5.1678 numMergedOcc 0
8 mol 69 unq 3 iso 0 dist 9.38571 4.95459 6.77443 7.21134 14.5169 11.1059 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.85705 6.10556 5.63251 5.05627 3.60945 3.98068 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 5.82681 8.34668 10.1169 8.9388 11.3012 4.03697 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 5.82681 8.76308 4.93748 8.9388 11.3012 14.8715 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 9.30279 9.42329 10.4519 9.94292 13.7436 3.93305 numMergedOcc 0
13 mol 217 unq 0 iso 0 dist 9.91392 5.88992 7.70552 9.41353 7.95169 11.304 numMergedOcc 0
14 mol 217 unq 1 iso 0 dist 9.91392 5.88992 7.70552 8.28155 10.6585 9.98266 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 8.90583 8.31751 7.20864 8.34875 5.27153 5.99712 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 6.99317 5.74541 4.4231 8.56943 9.82337 10.2835 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 6.45266 5.27184 7.43301 5.9625 4.12474 3.86189 numMergedOcc 0
18 mol 236 unq 1 iso 0 dist 6.45266 7.98527 4.22734 5.9625 4.12474 5.69926 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.17075 8.31182 14.8724 7.30349 15.4022 10.0756 numMergedOcc 0
