0 mol 21 unq 0 iso 0 dist 5.27589 8.06022 11.3369 4.2995 7.30688 10.56 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 5.27589 8.06022 11.3369 5.73645 6.70786 10.7539 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 5.27589 8.06022 11.3369 5.29979 8.16395 11.2034 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 7.19567 9.57204 4.9086 6.59001 9.0979 10.4578 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.32436 6.53191 9.80109 5.61075 9.87963 8.8015 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 9.28075 9.92545 6.55138 5.55348 7.80026 11.5247 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 6.30598 8.03628 6.87788 5.03358 8.52436 6.2454 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 8.30129 7.38908 5.99078 8.87512 9.41326 12.5396 numMergedOcc 0
8 mol 126 unq 0 iso 0 dist 9.40595 9.9347 5.6352 6.51437 9.93116 11.4056 numMergedOcc 0
9 mol 126 unq 1 iso 0 dist 9.40595 4.92321 7.68024 6.51437 9.93116 9.52509 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.10839 8.32453 7.13388 9.1255 9.70788 13.1485 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 5.78662 9.3072 6.51997 8.23396 8.09064 5.20262 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 5.47823 8.78461 6.53628 7.40922 8.00956 5.21792 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.35708 9.76509 9.79728 14.2497 5.27578 13.507 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 8.40313 9.76509 9.21526 14.2497 8.25953 13.507 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 7.70005 7.19347 5.21449 5.70815 8.98494 9.63418 numMergedOcc 0
16 mol 229 unq 0 iso 0 dist 7.10623 7.35566 6.3257 5.21449 7.9433 11.4325 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.41633 6.05785 4.28792 6.11396 9.32928 5.68578 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 9.41633 9.46904 15.8078 6.11396 9.32928 10.0041 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 8.78219 8.55696 16.9472 8.86075 7.97711 14.9147 numMergedOcc 0
20 mol 266 unq 1 iso 0 dist 8.78219 7.45814 5.25529 8.86075 7.97711 11.595 numMergedOcc 0
21 mol 273 unq 0 iso 0 dist 7.29081 8.24507 4.62586 15.3556 8.66133 10.2471 numMergedOcc 0
22 mol 273 unq 1 iso 0 dist 7.29081 8.24507 4.62586 4.3735 6.95569 5.63226 numMergedOcc 0
23 mol 292 unq 0 iso 0 dist 9.73559 9.94289 6.01509 8.29235 6.78424 7.02131 numMergedOcc 0
24 mol 292 unq 1 iso 0 dist 9.73559 9.94289 6.01509 11.5319 7.32002 6.79765 numMergedOcc 0
