0 mol 14 unq 0 iso 0 dist 9.31993 8.64855 5.51361 5.5336 9.70544 7.0208 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.34433 6.84521 12.3867 5.00932 5.5483 8.99509 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 9.34433 6.84521 12.3867 15.9323 9.30432 19.8731 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 9.34433 8.90024 12.0037 5.00932 5.5483 8.47617 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 9.34433 8.90024 12.0037 15.9323 9.30432 17.7518 numMergedOcc 0
5 mol 43 unq 4 iso 0 dist 9.34433 6.78532 6.9067 5.00932 5.5483 5.73331 numMergedOcc 0
6 mol 43 unq 5 iso 0 dist 9.34433 6.78532 6.9067 15.9323 9.30432 15.1227 numMergedOcc 0
7 mol 43 unq 6 iso 0 dist 5.63207 6.35333 5.90331 7.4373 5.5483 10.7889 numMergedOcc 0
8 mol 43 unq 7 iso 0 dist 5.63207 6.35333 5.90331 5.81652 9.30432 6.6657 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 6.09042 8.27156 10.894 5.46519 8.73923 12.7661 numMergedOcc 0
10 mol 69 unq 0 iso 0 dist 6.57452 8.29727 5.16822 4.9038 8.72237 12.0878 numMergedOcc 0
11 mol 189 unq 0 iso 0 dist 8.01521 8.59972 6.36139 5.79701 9.40683 12.8253 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 7.72368 7.80612 6.64693 4.72507 8.02005 4.89168 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 5.41885 7.91348 5.96471 9.94296 8.85493 14.782 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 6.20998 6.95233 5.98169 12.234 8.08479 12.4613 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 6.20998 9.61741 13.6708 12.234 8.08479 15.1536 numMergedOcc 0
16 mol 266 unq 2 iso 0 dist 6.20998 5.61056 10.2407 12.234 8.08479 15.2893 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 8.64546 6.94723 6.0971 5.45852 7.61357 5.59626 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 3.97964 6.52188 6.0971 4.78798 7.61357 5.59626 numMergedOcc 0
19 mol 280 unq 2 iso 0 dist 4.55639 6.94723 6.96139 4.85466 7.31523 7.1704 numMergedOcc 0
20 mol 280 unq 3 iso 0 dist 4.55639 6.94723 6.96139 5.45852 8.67836 5.59626 numMergedOcc 0
21 mol 280 unq 4 iso 0 dist 7.72152 6.52188 6.96139 9.78637 7.31523 7.1704 numMergedOcc 0
22 mol 280 unq 5 iso 0 dist 7.72152 6.52188 6.96139 4.78798 8.67836 5.59626 numMergedOcc 0
23 mol 281 unq 0 iso 0 dist 6.81536 9.37845 5.81338 12.6807 8.88843 12.8498 numMergedOcc 0
