0 mol 28 unq 0 iso 0 dist 6.62508 10.4653 9.4148 12.5323 7.15351 9.05939 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 6.62508 10.4653 9.4148 9.04621 6.51818 8.24422 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 6.62508 5.51879 6.87842 12.5323 7.15351 9.38747 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 6.62508 5.51879 6.87842 9.04621 6.51818 8.99724 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 9.77719 12.3614 9.4148 16.1571 7.15351 9.05939 numMergedOcc 0
5 mol 28 unq 5 iso 0 dist 9.77719 12.3614 9.4148 8.44081 6.51818 8.24422 numMergedOcc 0
6 mol 28 unq 6 iso 0 dist 9.77719 9.5295 6.87842 16.1571 7.15351 9.38747 numMergedOcc 0
7 mol 28 unq 7 iso 0 dist 9.77719 9.5295 6.87842 8.44081 6.51818 8.99724 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 9.4816 5.37962 9.62431 7.97907 4.475 7.64192 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 8.59002 4.81432 6.6536 10.3337 7.12458 6.39026 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 6.3407 4.69923 8.92597 4.67361 9.39472 8.63185 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 6.3407 11.9426 7.53734 5.70397 5.23547 8.27071 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 7.79613 13.7865 7.99441 14.2978 7.60854 5.17916 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 4.58113 5.97855 8.69052 12.5037 13.5014 7.0412 numMergedOcc 0
14 mol 267 unq 0 iso 0 dist 8.63426 10.5325 5.463 16.9437 9.10508 8.21131 numMergedOcc 0
15 mol 267 unq 1 iso 0 dist 8.04091 4.75234 5.463 12.2576 9.10508 8.21131 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.37164 5.87826 8.43856 6.75269 4.53492 8.5458 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 7.37164 5.87826 8.43856 10.5396 9.26749 8.56533 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 7.37164 6.18486 5.83857 6.75269 4.53492 8.47385 numMergedOcc 0
19 mol 287 unq 3 iso 0 dist 7.37164 9.62966 5.32839 6.75269 4.53492 8.44356 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.37164 5.87826 8.43856 6.75269 4.53492 8.5458 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 7.37164 5.87826 8.43856 10.5396 9.26749 8.56533 numMergedOcc 0
22 mol 288 unq 2 iso 0 dist 7.37164 6.18486 5.83857 6.75269 4.53492 8.47385 numMergedOcc 0
23 mol 288 unq 3 iso 0 dist 7.37164 9.62966 5.32839 6.75269 4.53492 8.44356 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 7.37164 5.87826 8.43856 6.75269 4.53492 8.5458 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 7.37164 5.87826 8.43856 10.5396 9.26749 8.56533 numMergedOcc 0
26 mol 289 unq 2 iso 0 dist 7.37164 6.18486 5.83857 6.75269 4.53492 8.47385 numMergedOcc 0
27 mol 289 unq 3 iso 0 dist 7.37164 9.62966 5.32839 6.75269 4.53492 8.44356 numMergedOcc 0
