0 mol 24 unq 0 iso 0 dist 6.44893 8.48944 5.11135 9.67461 4.93188 9.33482 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.44893 8.48944 5.11135 14.0586 9.24958 7.27472 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.44893 9.04448 8.10397 9.67461 4.93188 5.68215 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.44893 9.04448 8.10397 14.0586 9.24958 17.003 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.44893 6.6834 9.57743 9.67461 4.93188 10.9113 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 6.44893 6.6834 9.57743 14.0586 9.24958 16.707 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 9.17687 6.75521 8.41793 14.4151 9.93832 17.3252 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 9.17687 6.75521 8.41793 10.3283 8.60739 13.8936 numMergedOcc 0
8 mol 70 unq 0 iso 0 dist 4.67358 8.63204 9.34622 9.17087 9.31969 17.5432 numMergedOcc 0
9 mol 70 unq 1 iso 0 dist 4.67358 8.63204 9.34622 5.33532 6.54023 13.3074 numMergedOcc 0
10 mol 70 unq 2 iso 0 dist 4.67358 5.4014 5.89735 9.17087 9.31969 13.7011 numMergedOcc 0
11 mol 70 unq 3 iso 0 dist 4.67358 5.4014 5.89735 5.33532 6.54023 10.4272 numMergedOcc 0
12 mol 94 unq 0 iso 0 dist 7.63006 8.97936 6.05851 10.119 8.16733 13.2764 numMergedOcc 0
13 mol 94 unq 1 iso 0 dist 7.63006 8.97936 6.05851 6.26149 9.97569 12.2268 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 9.9387 6.62354 11.0597 10.4339 8.67766 12.448 numMergedOcc 0
15 mol 109 unq 1 iso 0 dist 9.9387 6.62354 11.0597 4.91393 8.0831 9.89083 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 5.8367 7.96353 11.1905 11.9678 7.36779 18.1131 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 5.8367 7.96353 11.1905 13.0109 8.20836 19.209 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 6.59729 8.9388 9.435 10.2733 6.72641 11.651 numMergedOcc 0
19 mol 188 unq 0 iso 0 dist 8.14959 8.01604 8.18087 11.4039 8.47347 12.632 numMergedOcc 0
20 mol 188 unq 1 iso 0 dist 8.14959 9.07006 5.51589 11.4039 8.47347 10.9261 numMergedOcc 0
21 mol 188 unq 2 iso 0 dist 5.36962 7.03264 8.18087 6.184 8.47347 12.632 numMergedOcc 0
22 mol 188 unq 3 iso 0 dist 5.36962 6.32826 5.51589 6.184 8.47347 10.9261 numMergedOcc 0
23 mol 195 unq 0 iso 0 dist 8.22643 8.08491 9.48862 4.98231 6.60567 7.41662 numMergedOcc 0
24 mol 195 unq 1 iso 0 dist 8.22643 8.08491 9.48862 13.577 7.62942 16.1768 numMergedOcc 0
25 mol 207 unq 0 iso 0 dist 9.72041 7.25953 5.34977 5.6688 8.85547 5.12567 numMergedOcc 0
26 mol 207 unq 1 iso 0 dist 9.72041 9.05688 5.34897 5.6688 8.85547 6.0563 numMergedOcc 0
27 mol 207 unq 2 iso 0 dist 5.86317 7.25953 5.47626 7.31502 8.32218 12.2823 numMergedOcc 0
28 mol 207 unq 3 iso 0 dist 5.86317 7.25953 5.47626 5.6688 7.96797 5.12567 numMergedOcc 0
29 mol 207 unq 4 iso 0 dist 5.86317 9.05688 7.64813 7.31502 8.32218 10.8457 numMergedOcc 0
30 mol 207 unq 5 iso 0 dist 5.86317 9.05688 7.64813 5.6688 7.96797 6.0563 numMergedOcc 0
31 mol 236 unq 0 iso 0 dist 9.33359 5.9625 8.32937 12.8358 8.50331 15.106 numMergedOcc 0
32 mol 248 unq 0 iso 0 dist 9.08064 5.65458 8.29191 7.63032 6.17052 10.6429 numMergedOcc 0
33 mol 248 unq 1 iso 0 dist 9.08064 5.65458 8.29191 6.42334 9.77666 10.9783 numMergedOcc 0
