0 mol 54 unq 0 iso 0 dist 6.13476 12.423 6.59893 15.9453 9.88291 5.01162 numMergedOcc 0
1 mol 108 unq 0 iso 0 dist 5.45787 6.97518 7.29462 8.69068 4.93762 5.52402 numMergedOcc 0
2 mol 108 unq 1 iso 0 dist 5.45787 6.97518 7.29462 13.5097 12.0414 6.79804 numMergedOcc 0
3 mol 108 unq 2 iso 0 dist 5.45787 4.62224 5.4057 8.69068 4.93762 7.57593 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 8.93253 9.6516 7.21229 13.703 6.12546 6.70591 numMergedOcc 0
5 mol 110 unq 1 iso 0 dist 8.93253 9.6516 7.21229 14.7439 9.24029 5.43052 numMergedOcc 0
6 mol 110 unq 2 iso 0 dist 8.1306 9.6516 5.25492 13.703 6.39786 6.70591 numMergedOcc 0
7 mol 110 unq 3 iso 0 dist 8.1306 9.6516 5.25492 14.7439 8.50777 5.43052 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 9.96969 4.23705 8.91606 9.31927 5.91353 9.12964 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.05674 5.48547 8.84018 9.86691 4.84607 6.85651 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.05674 5.48547 8.84018 12.4912 11.981 7.03858 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 9.14737 15.3424 8.64255 17.7459 13.0113 5.79753 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 9.14737 15.3424 8.64255 11.8525 4.57437 7.56537 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 8.48081 11.6202 4.58599 11.533 4.67262 5.01229 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 7.17032 3.90122 5.89084 13.1219 12.0816 9.36753 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 8.95261 13.3046 5.36776 13.3198 5.8531 8.43067 numMergedOcc 0
16 mol 257 unq 1 iso 0 dist 8.95261 13.3046 5.36776 13.2461 5.98419 7.6127 numMergedOcc 0
17 mol 257 unq 2 iso 0 dist 7.80336 11.62 5.36776 11.9642 5.8531 8.43067 numMergedOcc 0
18 mol 257 unq 3 iso 0 dist 7.80336 11.62 5.36776 13.3625 5.98419 7.6127 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 5.29682 4.98212 6.77279 8.93002 6.64729 5.98006 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 6.20344 4.98212 9.58006 8.93002 9.79538 5.98006 numMergedOcc 0
21 mol 259 unq 2 iso 0 dist 8.69345 5.42001 5.90381 11.6578 7.20428 9.30018 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 5.89409 13.0023 9.59213 10.2027 5.58514 6.98812 numMergedOcc 0
23 mol 265 unq 1 iso 0 dist 7.45719 12.5955 9.59213 9.83854 5.58514 6.98812 numMergedOcc 0
24 mol 265 unq 2 iso 0 dist 7.83102 10.5845 8.1498 14.2556 7.602 8.03655 numMergedOcc 0
