0 mol 15 unq 0 iso 0 dist 8.0637 4.98085 5.19544 9.94679 8.80394 6.03257 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 9.23692 12.5018 6.72084 20.898 12.1572 9.93096 numMergedOcc 0
2 mol 65 unq 0 iso 0 dist 7.62028 5.43428 5.83149 8.70783 6.59475 5.94206 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 9.71591 9.84867 9.78129 13.4292 6.04442 8.03296 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 9.71591 9.84867 9.78129 15.443 11.2226 9.26979 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 8.94991 5.85411 5.51406 12.6375 10.4949 8.66165 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.84583 7.65932 5.94696 9.66226 9.51607 7.36769 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 5.84583 7.65932 5.94696 11.8553 12.5752 6.88901 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 5.99873 7.46008 8.27794 15.5699 14.0508 8.42878 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 6.8456 4.95654 7.48533 7.27601 3.88006 8.42878 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.08733 10.2818 8.4733 12.336 5.73999 7.20249 numMergedOcc 0
11 mol 119 unq 1 iso 0 dist 4.90449 10.6827 8.4733 10.4792 5.73999 7.20249 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.34149 5.30646 5.56565 8.21272 5.21047 6.84835 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 9.8767 5.9053 7.04477 10.6409 11.378 5.70795 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 8.15743 14.8728 9.41148 8.70651 6.36084 9.78181 numMergedOcc 0
15 mol 232 unq 1 iso 0 dist 8.15743 4.03628 7.83422 8.70651 6.36084 9.8664 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 4.76689 4.48112 5.68717 10.808 7.55193 9.32954 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 8.79012 5.72956 5.68717 7.23618 7.55193 9.32954 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 6.84909 10.6051 6.68863 16.4532 10.8497 8.25485 numMergedOcc 0
