0 mol 1 unq 0 iso 0 dist 8.10712 8.93851 12.8632 9.40282 14.5115 9.98089 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.10712 8.93851 12.8632 9.35554 5.59021 15.6106 numMergedOcc 0
2 mol 2 unq 0 iso 0 dist 9.9335 9.49821 15.5299 7.99162 11.2776 4.67907 numMergedOcc 0
3 mol 7 unq 0 iso 0 dist 9.8592 6.95017 12.6897 8.48743 10.2888 5.5824 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 9.3613 4.97286 11.8192 8.36524 12.6572 11.7949 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 5.63207 9.75898 11.0116 6.35333 5.90331 14.1805 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 9.16791 8.23686 11.252 8.29727 8.77472 10.3017 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 9.16791 9.38571 7.3232 8.29727 8.77472 8.15522 numMergedOcc 0
8 mol 69 unq 2 iso 0 dist 6.57452 8.23686 7.91431 8.29727 5.16822 10.3017 numMergedOcc 0
9 mol 69 unq 3 iso 0 dist 6.57452 9.38571 11.4854 8.29727 5.16822 8.15522 numMergedOcc 0
10 mol 70 unq 0 iso 0 dist 6.538 7.10284 5.16319 8.63742 6.39257 8.75118 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 6.15949 8.85912 5.50163 6.99793 7.65733 11.1664 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 6.15949 8.85912 5.50163 6.71345 5.24877 4.77991 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.614 7.10634 5.6672 8.27794 11.0057 5.48043 numMergedOcc 0
14 mol 207 unq 0 iso 0 dist 5.65418 7.08146 9.1418 5.18312 6.32727 6.2409 numMergedOcc 0
15 mol 207 unq 1 iso 0 dist 4.70143 7.08146 5.55728 5.18312 7.53149 6.2409 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 9.20752 8.9906 17.3105 5.92907 9.95971 8.42394 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 7.21766 9.83755 14.0805 7.94344 3.99247 14.3395 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 5.46484 6.45266 6.93622 8.95071 6.49831 12.0614 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 8.80671 9.52945 16.6823 7.49412 6.81625 11.3652 numMergedOcc 0
20 mol 236 unq 2 iso 0 dist 9.81411 9.52945 13.4498 7.49412 8.27017 11.3652 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 7.16232 9.89398 13.7032 6.90245 7.93809 10.8667 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 6.93654 7.43425 7.35046 9.80409 13.3163 6.75336 numMergedOcc 0
23 mol 261 unq 1 iso 0 dist 9.66298 7.43425 7.98909 9.80409 13.6041 6.75336 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 6.20998 9.17075 6.69637 6.95233 5.98169 11.9164 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 6.20998 9.17075 6.69637 9.61741 13.6708 17.5279 numMergedOcc 0
26 mol 266 unq 2 iso 0 dist 6.20998 9.17075 6.69637 5.61056 10.2407 14.6838 numMergedOcc 0
27 mol 266 unq 3 iso 0 dist 8.78219 9.17075 5.60874 6.95233 13.8919 11.9164 numMergedOcc 0
28 mol 266 unq 4 iso 0 dist 8.78219 9.17075 5.60874 9.61741 16.7981 17.5279 numMergedOcc 0
29 mol 266 unq 5 iso 0 dist 8.78219 9.17075 5.60874 5.61056 14.0884 14.6838 numMergedOcc 0
30 mol 271 unq 0 iso 0 dist 7.34621 9.22385 8.85011 7.9494 4.87282 5.71631 numMergedOcc 0
31 mol 271 unq 1 iso 0 dist 7.34621 6.56531 5.25426 7.9494 4.87282 5.27791 numMergedOcc 0
32 mol 278 unq 0 iso 0 dist 7.74708 9.23937 10.8722 9.91518 4.69872 14.0179 numMergedOcc 0
33 mol 278 unq 1 iso 0 dist 6.03414 9.23937 5.63407 9.91518 8.66976 14.0179 numMergedOcc 0
34 mol 278 unq 2 iso 0 dist 9.82026 9.23937 4.53474 9.91518 17.1306 14.0179 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 4.98604 7.51034 10.1749 7.95849 5.10722 11.2254 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 4.98604 7.51034 10.1749 7.95849 5.10722 11.2254 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 4.98604 7.51034 10.1749 7.95849 5.10722 11.2254 numMergedOcc 0
