0 mol 20 unq 0 iso 0 dist 4.90613 6.30355 6.83357 6.13068 10.2799 7.68085 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 4.90613 6.02975 4.71011 6.13068 10.2799 8.45034 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 9.52936 9.01327 11.0079 4.23182 7.62621 8.6176 numMergedOcc 0
3 mol 108 unq 0 iso 0 dist 9.81705 9.33337 10.0665 16.4523 19.2692 9.87572 numMergedOcc 0
4 mol 108 unq 1 iso 0 dist 6.32309 9.33337 6.5597 16.4523 15.3528 9.87572 numMergedOcc 0
5 mol 108 unq 2 iso 0 dist 8.60437 9.33337 3.6703 16.4523 13.4848 9.87572 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.61273 9.64066 5.47938 9.18926 10.8007 6.84082 numMergedOcc 0
7 mol 120 unq 1 iso 0 dist 9.61273 9.64066 5.47938 11.2623 11.6777 8.66256 numMergedOcc 0
8 mol 120 unq 2 iso 0 dist 9.61273 9.64066 5.47938 9.29912 12.5885 8.08194 numMergedOcc 0
9 mol 120 unq 3 iso 0 dist 9.61273 9.64066 5.47938 16.3041 15.284 9.89622 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 9.1717 6.98057 12.5558 10.2381 15.0363 6.18881 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 9.1717 6.98057 12.5558 7.48119 16.6061 9.35927 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 5.52744 9.44052 5.81649 8.66215 7.45384 8.71602 numMergedOcc 0
13 mol 247 unq 0 iso 0 dist 6.52457 6.16117 3.56045 7.07563 8.28575 5.89063 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 5.06731 8.0077 6.80232 11.8278 12.3269 6.08044 numMergedOcc 0
15 mol 287 unq 1 iso 0 dist 5.06731 8.0077 6.80232 9.89605 12.8617 8.8956 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 5.06731 8.0077 6.80232 11.8278 12.3269 6.08044 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 5.06731 8.0077 6.80232 9.89605 12.8617 8.8956 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 5.06731 8.0077 6.80232 11.8278 12.3269 6.08044 numMergedOcc 0
19 mol 289 unq 1 iso 0 dist 5.06731 8.0077 6.80232 9.89605 12.8617 8.8956 numMergedOcc 0
