0 mol 24 unq 0 iso 0 dist 6.85331 4.61828 6.00575 8.14598 5.69214 4.47891 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.36645 7.31914 7.34452 6.68961 7.14094 6.64869 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 8.94173 8.83047 13.3355 9.73556 5.62731 11.4508 numMergedOcc 0
3 mol 53 unq 1 iso 0 dist 8.62669 6.95013 8.64107 8.79235 10.4432 14.7368 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 7.9572 6.0478 5.6313 6.44825 9.25732 9.4319 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 8.64208 6.0478 4.72525 6.44825 13.625 9.4319 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.29323 6.96576 5.88839 9.41326 5.0295 6.68437 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 9.29323 9.55766 9.25244 9.41326 5.0295 5.90284 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 9.05626 4.85559 5.97111 9.67398 4.97996 6.76477 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 6.01711 6.81707 5.487 9.67711 7.5383 6.1593 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 8.84671 4.0037 10.7924 6.95244 7.73027 10.7636 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 8.84671 4.0037 10.7924 6.11224 8.97627 9.14584 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.03597 4.97005 7.63746 9.76574 5.1409 9.40383 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.03597 7.22 5.8893 9.76574 5.1409 9.88154 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 8.03597 6.81388 6.41592 9.76574 5.1409 11.0366 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 9.08672 5.67811 5.81909 9.77333 7.31335 7.26749 numMergedOcc 0
16 mol 186 unq 4 iso 0 dist 9.08672 8.74308 14.4635 9.77333 7.31335 9.78272 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 9.4835 8.67237 15.3526 8.44407 13.9529 8.18307 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 9.4835 8.67237 15.3526 6.0155 8.52282 10.8944 numMergedOcc 0
19 mol 214 unq 2 iso 0 dist 9.4835 8.67237 15.3526 8.89981 8.48942 13.1907 numMergedOcc 0
20 mol 214 unq 3 iso 0 dist 9.4835 7.49436 6.00534 8.44407 13.9529 12.2159 numMergedOcc 0
21 mol 214 unq 4 iso 0 dist 9.4835 7.49436 6.00534 6.0155 8.52282 8.87863 numMergedOcc 0
22 mol 214 unq 5 iso 0 dist 9.4835 7.49436 6.00534 8.89981 8.48942 5.52297 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.30244 8.31564 14.3172 8.63649 14.9028 5.24307 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 7.29796 8.31564 11.1607 8.63649 14.1071 5.24307 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 7.72749 7.25797 7.26083 4.93584 4.74189 3.34253 numMergedOcc 0
