0 mol 1 unq 0 iso 0 dist 9.48433 6.28655 8.56884 13.3514 6.44928 9.44115 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.48433 6.28655 8.56884 5.87976 6.35409 7.90928 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 8.88829 5.91961 8.68559 13.4841 14.4244 7.88576 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 8.71603 11.6458 9.2603 10.5126 4.0486 5.82918 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.364 6.94038 8.39016 10.6214 9.43289 9.30724 numMergedOcc 0
5 mol 90 unq 1 iso 0 dist 7.37255 7.88117 8.39016 14.575 9.43289 9.30724 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 6.97244 11.7596 7.20326 15.0035 11.1675 8.0578 numMergedOcc 0
7 mol 117 unq 1 iso 0 dist 6.97244 11.7596 7.20326 13.6729 6.7814 8.78982 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 6.44766 8.49634 6.91348 9.87066 5.59449 9.90096 numMergedOcc 0
9 mol 155 unq 0 iso 0 dist 9.56095 10.5066 9.86313 17.2608 14.7279 7.62575 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 9.72828 6.76195 6.98095 8.91036 10.8336 9.56248 numMergedOcc 0
11 mol 183 unq 0 iso 0 dist 9.60878 6.06625 7.01383 13.255 7.79648 7.42108 numMergedOcc 0
12 mol 183 unq 1 iso 0 dist 9.60878 6.06625 7.01383 10.8691 6.50505 9.19941 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 9.00273 12.8534 8.99696 10.3338 10.5326 8.32685 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 9.00273 12.8534 8.99696 9.01037 5.29309 6.74777 numMergedOcc 0
15 mol 197 unq 2 iso 0 dist 9.00273 12.8534 8.99696 11.6782 4.57437 9.62514 numMergedOcc 0
16 mol 197 unq 3 iso 0 dist 7.19387 15.758 8.99696 15.6565 10.5326 8.32685 numMergedOcc 0
17 mol 197 unq 4 iso 0 dist 7.19387 15.758 8.99696 11.3312 5.29309 6.74777 numMergedOcc 0
18 mol 197 unq 5 iso 0 dist 7.19387 15.758 8.99696 10.1866 4.57437 9.62514 numMergedOcc 0
19 mol 222 unq 0 iso 0 dist 8.81925 4.95108 6.82208 6.17749 4.82768 7.35476 numMergedOcc 0
20 mol 233 unq 0 iso 0 dist 9.39439 6.99665 9.43203 14.504 12.3957 7.83363 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 6.0087 9.3775 7.17676 15.3719 11.2013 6.98151 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 9.94587 12.3467 6.91569 19.956 11.9794 9.88122 numMergedOcc 0
23 mol 243 unq 0 iso 0 dist 8.19458 13.3811 8.61104 17.3629 10.3202 8.53888 numMergedOcc 0
24 mol 243 unq 1 iso 0 dist 8.19458 13.3811 8.61104 14.3251 10.1405 9.46855 numMergedOcc 0
