0 mol 10 unq 0 iso 0 dist 7.3489 9.09854 5.41302 10.9317 9.1686 14.5233 14.2329 9.75001 13.7435 8.18003 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 7.3489 9.09854 5.41302 10.9317 9.1686 14.5233 13.9362 9.06457 11.0246 11.9528 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 7.3489 9.09854 5.41302 15.2253 8.99402 12.2109 14.2329 9.75001 13.7435 4.22006 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 7.3489 9.09854 5.41302 15.2253 8.99402 12.2109 13.9362 9.06457 11.0246 4.87654 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.14636 7.66471 9.8912 8.81759 9.53303 15.9903 7.92329 9.29917 14.2863 3.98875 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.4438 5.14178 5.7253 11.6681 5.92936 9.68592 4.93697 7.75341 5.17145 8.57639 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 7.9663 4.85559 4.79695 5.84182 6.54338 6.87562 7.12852 7.06547 6.5739 3.79867 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 7.9663 4.85559 4.79695 13.2888 7.47653 11.6546 7.12852 7.06547 6.5739 9.23498 numMergedOcc 0
8 mol 130 unq 2 iso 0 dist 6.54338 6.87562 4.79695 5.84182 7.9663 4.85559 3.79867 7.06547 6.5739 7.12852 numMergedOcc 0
9 mol 130 unq 3 iso 0 dist 6.54338 6.87562 4.79695 8.39466 7.47653 11.6546 3.79867 7.06547 6.5739 9.23498 numMergedOcc 0
10 mol 218 unq 0 iso 0 dist 8.44004 8.23919 5.18278 6.98423 4.61671 8.71719 7.45028 8.38813 9.11192 8.06186 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 8.42706 9.98606 17.6604 6.70676 6.58277 15.2583 16.8963 9.97206 26.7768 12.6355 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 8.42706 9.98606 17.6604 16.4476 8.12204 25.7504 16.8963 9.97206 26.7768 5.85295 numMergedOcc 0
13 mol 279 unq 0 iso 0 dist 5.78017 7.5355 7.91886 6.22487 6.12742 7.88343 4.91802 8.9352 5.81528 9.35656 numMergedOcc 0
14 mol 279 unq 1 iso 0 dist 6.12742 7.88343 7.91886 6.22487 5.78017 7.5355 9.35656 8.9352 5.81528 4.91802 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 4.49185 6.53393 5.97691 4.88833 7.22938 11.0635 10.6613 9.94851 12.6719 12.7859 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 4.49185 6.53393 5.97691 9.86126 9.94176 15.1591 10.6613 9.94851 12.6719 15.0697 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 4.49185 6.53393 5.97691 4.88833 7.22938 11.0635 10.6613 9.94851 12.6719 12.7859 numMergedOcc 0
18 mol 288 unq 1 iso 0 dist 4.49185 6.53393 5.97691 9.86126 9.94176 15.1591 10.6613 9.94851 12.6719 15.0697 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 4.49185 6.53393 5.97691 4.88833 7.22938 11.0635 10.6613 9.94851 12.6719 12.7859 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 4.49185 6.53393 5.97691 9.86126 9.94176 15.1591 10.6613 9.94851 12.6719 15.0697 numMergedOcc 0
