0 mol 28 unq 0 iso 0 dist 9.3223 4.24515 9.4148 11.8051 7.15351 9.05939 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 9.3223 4.24515 9.4148 7.43758 6.51818 8.24422 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 9.3223 5.03315 6.87842 11.8051 7.15351 9.38747 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 9.3223 5.03315 6.87842 7.43758 6.51818 8.99724 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.57705 4.95628 7.79538 10.4576 7.08619 9.8089 numMergedOcc 0
5 mol 87 unq 0 iso 0 dist 9.32056 6.79748 8.81954 12.5082 7.42523 7.35921 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 9.81212 4.81561 7.94976 12.9009 10.2277 9.27341 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 7.25009 5.49557 8.99128 7.49276 10.541 9.06599 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 6.52441 7.99002 6.84679 11.1549 9.55695 7.6409 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 6.0033 10.3089 7.86042 12.7918 8.55619 7.69352 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 7.25438 10.6299 8.69052 17.3102 13.5014 7.0412 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 7.13727 5.64173 5.52788 5.83646 4.48114 7.75366 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 8.56975 4.11566 5.52788 9.69906 4.48114 7.75366 numMergedOcc 0
13 mol 283 unq 0 iso 0 dist 7.81241 4.01355 5.32876 5.96202 5.83652 6.93798 numMergedOcc 0
14 mol 283 unq 1 iso 0 dist 9.52445 4.01355 7.60296 5.96202 5.99759 6.93798 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 9.14467 6.28227 8.43856 10.9025 4.53492 8.5458 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 9.14467 6.28227 8.43856 13.9133 9.26749 8.56533 numMergedOcc 0
17 mol 287 unq 2 iso 0 dist 9.14467 4.35239 5.83857 10.9025 4.53492 8.47385 numMergedOcc 0
18 mol 287 unq 3 iso 0 dist 9.14467 10.5443 5.32839 10.9025 4.53492 8.44356 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 9.14467 6.28227 8.43856 10.9025 4.53492 8.5458 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 9.14467 6.28227 8.43856 13.9133 9.26749 8.56533 numMergedOcc 0
21 mol 288 unq 2 iso 0 dist 9.14467 4.35239 5.83857 10.9025 4.53492 8.47385 numMergedOcc 0
22 mol 288 unq 3 iso 0 dist 9.14467 10.5443 5.32839 10.9025 4.53492 8.44356 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.14467 6.28227 8.43856 10.9025 4.53492 8.5458 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 9.14467 6.28227 8.43856 13.9133 9.26749 8.56533 numMergedOcc 0
25 mol 289 unq 2 iso 0 dist 9.14467 4.35239 5.83857 10.9025 4.53492 8.47385 numMergedOcc 0
26 mol 289 unq 3 iso 0 dist 9.14467 10.5443 5.32839 10.9025 4.53492 8.44356 numMergedOcc 0
