0 mol 11 unq 0 iso 0 dist 7.85585 11.682 9.07476 11.9421 6.83186 9.46202 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 7.92563 11.4541 9.04534 11.9204 6.83186 9.26728 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 9.75794 14.8363 7.25138 8.93653 4.46067 6.13411 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.06999 10.7186 5.57551 5.19109 7.7485 7.27578 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 8.04721 5.09727 7.39028 4.53269 9.51764 9.3283 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 8.04721 5.09727 7.39028 6.90764 9.29327 3.98588 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 8.28997 10.8873 7.96893 9.40786 5.31126 3.74516 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 8.28997 10.8873 7.96893 4.37694 4.49669 7.32784 numMergedOcc 0
8 mol 113 unq 2 iso 0 dist 8.28997 10.8873 7.96893 6.31995 6.00221 8.46561 numMergedOcc 0
9 mol 113 unq 3 iso 0 dist 7.98399 9.36148 7.96893 9.26558 5.31126 3.74516 numMergedOcc 0
10 mol 113 unq 4 iso 0 dist 7.98399 9.36148 7.96893 10.9453 4.49669 7.32784 numMergedOcc 0
11 mol 113 unq 5 iso 0 dist 7.98399 9.36148 7.96893 10.0348 6.00221 8.46561 numMergedOcc 0
12 mol 113 unq 6 iso 0 dist 9.72242 13.1071 7.08403 11.6507 7.02358 3.77247 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 7.5669 9.19866 7.78577 9.08641 5.10589 3.69097 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 7.5669 9.19866 7.78577 10.9154 4.63336 7.14832 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 7.5669 9.19866 7.78577 10.1806 6.10715 8.01356 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 9.57261 5.77371 7.65214 9.32731 9.21536 3.62053 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 6.99201 9.38036 9.14525 7.8793 7.25595 13.1776 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 6.99201 9.38036 9.14525 11.482 9.94825 4.10348 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.82242 6.26153 8.54126 11.7987 9.64861 8.96559 numMergedOcc 0
20 mol 232 unq 1 iso 0 dist 8.82242 8.73691 7.64079 11.7987 9.64861 6.09979 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 5.99705 13.6326 8.72101 10.9076 7.98956 14.313 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 5.99705 13.6326 8.72101 7.81318 5.86185 13.2017 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 5.99705 13.6326 8.72101 8.19724 6.79748 10.3346 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 5.99705 4.82882 5.11998 10.9076 7.98956 7.31817 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 5.99705 4.82882 5.11998 7.81318 5.86185 3.91224 numMergedOcc 0
26 mol 277 unq 5 iso 0 dist 5.99705 4.82882 5.11998 8.19724 6.79748 10.8296 numMergedOcc 0
27 mol 277 unq 6 iso 0 dist 5.04543 13.6326 8.75619 8.19724 6.53598 10.3346 numMergedOcc 0
28 mol 277 unq 7 iso 0 dist 5.04543 4.82882 5.79925 8.19724 6.53598 10.8296 numMergedOcc 0
29 mol 277 unq 8 iso 0 dist 5.04543 7.5495 8.55906 8.19724 6.53598 8.55356 numMergedOcc 0
30 mol 277 unq 9 iso 0 dist 5.04543 9.16695 5.55523 8.19724 6.53598 10.7151 numMergedOcc 0
31 mol 277 unq 10 iso 0 dist 8.99501 17.0068 8.75619 12.0119 6.53598 10.3346 numMergedOcc 0
32 mol 277 unq 11 iso 0 dist 8.99501 10.4709 5.79925 12.0119 6.53598 10.8296 numMergedOcc 0
33 mol 277 unq 12 iso 0 dist 8.99501 5.08958 8.55906 12.0119 6.53598 8.55356 numMergedOcc 0
34 mol 277 unq 13 iso 0 dist 8.99501 9.02911 5.55523 12.0119 6.53598 10.7151 numMergedOcc 0
35 mol 281 unq 0 iso 0 dist 7.55248 13.9262 6.82918 4.60355 7.90368 13.5758 numMergedOcc 0
36 mol 281 unq 1 iso 0 dist 7.55248 13.9262 6.82918 10.5706 6.69267 7.74065 numMergedOcc 0
37 mol 281 unq 2 iso 0 dist 6.50041 9.83564 6.82918 6.21647 7.90368 13.5758 numMergedOcc 0
38 mol 281 unq 3 iso 0 dist 6.50041 9.83564 6.82918 8.67682 6.69267 7.74065 numMergedOcc 0
39 mol 281 unq 4 iso 0 dist 5.70591 8.53439 9.13909 9.7837 5.33372 9.85344 numMergedOcc 0
40 mol 281 unq 5 iso 0 dist 5.70591 8.53439 9.13909 8.67682 6.56886 9.11195 numMergedOcc 0
41 mol 281 unq 6 iso 0 dist 5.70591 9.83564 4.29351 9.7837 5.33372 3.50686 numMergedOcc 0
42 mol 281 unq 7 iso 0 dist 5.70591 9.83564 4.29351 8.67682 6.56886 7.74065 numMergedOcc 0
43 mol 285 unq 0 iso 0 dist 6.5191 6.5189 6.73396 10.9233 5.88958 7.01472 numMergedOcc 0
44 mol 285 unq 1 iso 0 dist 6.5191 6.5189 6.73396 14.0087 7.78121 11.0045 numMergedOcc 0
