0 mol 10 unq 0 iso 0 dist 9.31452 8.95503 6.17554 6.23648 6.47443 6.02154 numMergedOcc 0
1 mol 119 unq 0 iso 0 dist 8.27253 9.47892 11.0594 13.9667 14.9625 6.55202 numMergedOcc 0
2 mol 119 unq 1 iso 0 dist 8.27253 9.47892 11.0594 15.453 18.8411 9.08536 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 8.03015 7.74744 5.10902 10.7383 11.1153 7.54341 numMergedOcc 0
4 mol 155 unq 0 iso 0 dist 6.80942 7.50392 7.441 5.68679 8.14405 7.29911 numMergedOcc 0
5 mol 155 unq 1 iso 0 dist 6.80942 8.77391 6.79302 5.68679 8.14405 5.36254 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 9.32658 7.65559 4.55959 3.72135 8.0852 6.65272 numMergedOcc 0
7 mol 162 unq 1 iso 0 dist 9.32658 7.65559 4.55959 7.66483 8.83222 9.66989 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.9855 9.56248 9.82963 15.8873 14.0366 8.62366 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 9.9855 9.56248 9.82963 14.9274 16.9231 9.44973 numMergedOcc 0
10 mol 173 unq 2 iso 0 dist 9.9855 9.56248 9.82963 9.35913 11.1625 6.52508 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 9.51041 9.00025 3.81023 4.6563 10.9815 9.65629 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 9.14877 6.17129 6.09218 7.19461 9.86015 9.09234 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 9.14877 6.17129 6.09218 9.77747 12.3619 6.76746 numMergedOcc 0
14 mol 181 unq 2 iso 0 dist 9.14877 6.17129 6.09218 10.0615 14.0951 8.92098 numMergedOcc 0
15 mol 181 unq 3 iso 0 dist 8.18021 6.17129 8.78318 7.19461 13.6966 9.09234 numMergedOcc 0
16 mol 181 unq 4 iso 0 dist 8.18021 6.17129 8.78318 9.77747 14.8505 6.76746 numMergedOcc 0
17 mol 181 unq 5 iso 0 dist 8.18021 6.17129 8.78318 10.0615 16.671 8.92098 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 9.08655 6.289 9.24953 5.18485 13.5497 7.10155 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 9.08655 6.289 9.24953 3.86206 9.26885 6.11135 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 9.48833 7.90156 7.85937 11.2254 13.626 8.61306 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 8.75001 9.94175 11.121 10.2069 17.0378 9.38131 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 9.18345 8.81534 5.58989 16.1646 14.738 9.38131 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 9.80725 9.53092 5.4536 9.92544 9.2885 8.84648 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 9.80725 9.53092 5.4536 12.9171 10.5384 6.23661 numMergedOcc 0
