0 mol 26 unq 0 iso 0 dist 8.36742 10.4631 9.82851 13.689 12.335 7.35861 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.36742 12.1978 9.11311 15.0906 12.5394 6.56527 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 7.47596 4.47203 6.53981 11.5351 8.06674 7.48846 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 7.62814 6.57199 8.75957 8.7388 10.1455 9.17082 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 9.63616 5.01159 5.27979 13.2094 10.1434 9.17082 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.60619 8.89371 8.84225 9.02674 4.37918 8.03296 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 7.60619 8.89371 8.84225 12.7962 9.08423 5.82754 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 7.60619 8.89371 8.84225 12.4348 6.29733 8.87742 numMergedOcc 0
8 mol 79 unq 3 iso 0 dist 7.60619 9.72544 6.72546 9.02674 4.37918 9.26979 numMergedOcc 0
9 mol 79 unq 4 iso 0 dist 7.60619 9.72544 6.72546 12.7962 9.08423 9.05679 numMergedOcc 0
10 mol 79 unq 5 iso 0 dist 7.60619 9.72544 6.72546 12.4348 6.29733 4.93468 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 8.73798 4.81103 7.54574 6.04768 10.256 7.14031 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 5.24616 7.22196 7.54574 9.40173 10.256 7.14031 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 9.5434 9.38204 6.07633 11.4976 7.28191 8.88394 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 7.382 10.6596 7.84546 10.9017 4.60864 5.87084 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 8.41675 7.73074 8.47526 9.99644 4.94367 5.87084 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 7.57472 6.69013 4.92382 15.5942 13.8739 9.83945 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 4.93944 14.0112 9.59109 7.66512 3.80087 9.83945 numMergedOcc 0
18 mol 141 unq 2 iso 0 dist 4.93944 14.0112 9.59109 7.38183 3.80763 6.75376 numMergedOcc 0
19 mol 141 unq 3 iso 0 dist 4.93944 14.0112 9.59109 11.3573 9.98068 9.10042 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.62945 5.96605 5.25762 8.09667 5.39534 6.21159 numMergedOcc 0
21 mol 249 unq 0 iso 0 dist 5.7671 10.5246 8.76518 15.1253 11.2713 5.9627 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 4.20369 6.93843 6.12343 13.424 9.82931 9.32954 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 9.76634 6.84952 8.09181 12.6353 8.87313 6.88827 numMergedOcc 0
24 mol 274 unq 1 iso 0 dist 9.76634 6.84952 8.09181 12.12 6.97575 9.16942 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 9.2144 9.52438 9.23152 8.53802 5.9468 6.95912 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.2144 9.52438 9.23152 8.53802 5.9468 6.95912 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 9.2144 9.52438 9.23152 8.53802 5.9468 6.95912 numMergedOcc 0
