0 mol 1 unq 0 iso 0 dist 7.21349 7.90928 9.45781 9.99706 16.0691 9.44115 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 4.81943 8.06002 5.34599 14.0125 12.9269 7.78618 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 6.64605 6.69711 4.21185 13.27 13.4083 9.30041 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 9.59131 8.91418 5.14132 10.7739 10.2426 6.0961 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 9.25641 7.23261 11.0273 5.12876 12.9139 8.96501 numMergedOcc 0
5 mol 44 unq 1 iso 0 dist 9.25641 7.23261 11.0273 6.85995 15.8359 9.4798 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 4.67917 8.17564 8.85727 3.8971 6.88924 7.19213 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 4.67917 8.17564 8.85727 14.4502 13.3001 6.94351 numMergedOcc 0
8 mol 59 unq 2 iso 0 dist 5.81747 8.17564 4.07863 3.8971 6.81975 7.19213 numMergedOcc 0
9 mol 59 unq 3 iso 0 dist 5.81747 8.17564 4.07863 14.4502 10.0694 6.94351 numMergedOcc 0
10 mol 59 unq 4 iso 0 dist 6.88924 7.19213 8.85727 3.8971 4.67917 8.17564 numMergedOcc 0
11 mol 59 unq 5 iso 0 dist 6.88924 7.19213 8.85727 13.5267 13.3001 6.94351 numMergedOcc 0
12 mol 59 unq 6 iso 0 dist 6.81975 7.19213 4.07863 3.8971 5.81747 8.17564 numMergedOcc 0
13 mol 59 unq 7 iso 0 dist 6.81975 7.19213 4.07863 13.5267 10.0694 6.94351 numMergedOcc 0
14 mol 76 unq 0 iso 0 dist 9.4022 8.39101 4.42702 8.17321 10.6928 6.57826 numMergedOcc 0
15 mol 78 unq 0 iso 0 dist 8.92399 9.4909 9.26242 10.0477 16.0466 9.15288 numMergedOcc 0
16 mol 155 unq 0 iso 0 dist 6.91762 8.02593 4.40049 9.95765 12.165 8.77391 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.75545 8.45395 6.22085 4.09371 8.86645 9.15368 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 5.75545 8.45395 6.22085 7.37799 11.1461 9.20477 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 5.75545 5.41368 4.48609 4.09371 8.86645 7.96182 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 5.75545 5.41368 4.48609 7.37799 11.1461 7.90237 numMergedOcc 0
21 mol 181 unq 4 iso 0 dist 8.86645 9.15368 6.22085 4.09371 5.75545 8.45395 numMergedOcc 0
22 mol 181 unq 5 iso 0 dist 8.86645 9.15368 6.22085 5.54834 11.1461 9.20477 numMergedOcc 0
23 mol 181 unq 6 iso 0 dist 8.86645 7.96182 4.48609 4.09371 5.75545 5.41368 numMergedOcc 0
24 mol 181 unq 7 iso 0 dist 8.86645 7.96182 4.48609 5.54834 11.1461 7.90237 numMergedOcc 0
25 mol 183 unq 0 iso 0 dist 8.15747 7.42108 9.54124 9.96454 16.7842 9.19941 numMergedOcc 0
26 mol 183 unq 1 iso 0 dist 5.44125 7.42108 9.81014 9.96454 8.7143 9.19941 numMergedOcc 0
27 mol 183 unq 2 iso 0 dist 8.7143 9.19941 9.81014 9.96454 5.44125 7.42108 numMergedOcc 0
28 mol 243 unq 0 iso 0 dist 5.86679 6.9453 4.20431 9.08852 12.2591 9.65322 numMergedOcc 0
29 mol 243 unq 1 iso 0 dist 5.86679 8.53888 4.12468 6.68091 8.28347 9.46855 numMergedOcc 0
30 mol 243 unq 2 iso 0 dist 8.28347 6.9453 10.5337 9.08852 16.1357 9.65322 numMergedOcc 0
31 mol 243 unq 3 iso 0 dist 8.28347 9.46855 4.12468 6.68091 5.86679 8.53888 numMergedOcc 0
32 mol 247 unq 0 iso 0 dist 9.65548 9.6455 4.32191 18.3145 10.4746 9.76925 numMergedOcc 0
33 mol 285 unq 0 iso 0 dist 8.12306 8.96754 10.7671 14.6038 18.6926 8.85005 numMergedOcc 0
