0 mol 1 unq 0 iso 0 dist 7.94669 7.81034 4.95929 6.4181 8.34833 4.58277 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.94669 9.19497 5.11065 6.4181 8.34833 9.98089 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 6.71467 8.6338 7.92278 9.22002 10.8063 11.2947 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 6.71467 8.6338 7.92278 7.52103 6.66385 4.78811 numMergedOcc 0
4 mol 61 unq 2 iso 0 dist 6.71467 7.63159 4.56037 9.22002 10.8063 13.0859 numMergedOcc 0
5 mol 61 unq 3 iso 0 dist 6.71467 7.63159 4.56037 7.52103 6.66385 7.13676 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.1662 7.09184 13.0828 8.94945 7.01367 8.95233 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 8.34804 8.39857 14.8076 9.46247 11 8.06806 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 7.21809 7.00234 6.99469 8.91902 9.27886 4.33228 numMergedOcc 0
9 mol 69 unq 1 iso 0 dist 5.69055 7.30652 6.99469 5.47319 7.76775 7.0643 numMergedOcc 0
10 mol 69 unq 2 iso 0 dist 5.69055 7.30652 6.99469 9.8809 13.1847 15.5982 numMergedOcc 0
11 mol 75 unq 0 iso 0 dist 5.01633 9.01568 5.19081 6.95595 5.56574 4.95201 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 7.25561 9.33989 6.6711 9.71952 13.0619 8.73236 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 8.97499 8.57953 6.6711 7.28257 13.0619 8.73236 numMergedOcc 0
14 mol 88 unq 0 iso 0 dist 5.74637 8.87089 6.09578 7.74197 13.1838 14.8536 numMergedOcc 0
15 mol 88 unq 1 iso 0 dist 5.74637 8.87089 6.09578 7.86537 12.6939 16.4761 numMergedOcc 0
16 mol 88 unq 2 iso 0 dist 5.74637 8.87089 6.09578 6.35462 6.63027 7.86667 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 7.63904 8.65008 6.12711 7.26897 6.03387 11.181 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 7.7013 8.57666 4.40729 8.58906 5.52686 5.34813 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 6.9705 9.32606 10.0449 9.66407 5.17719 14.4797 numMergedOcc 0
20 mol 185 unq 0 iso 0 dist 8.2968 8.85182 4.94279 9.878 10.3307 6.99799 numMergedOcc 0
21 mol 185 unq 1 iso 0 dist 8.2968 5.7065 7.94486 9.878 10.3307 12.6202 numMergedOcc 0
22 mol 210 unq 0 iso 0 dist 5.33103 5.70065 9.12311 8.62103 11.5481 5.4508 numMergedOcc 0
23 mol 210 unq 1 iso 0 dist 9.01301 5.70065 7.75472 8.62103 8.72811 5.4508 numMergedOcc 0
24 mol 213 unq 0 iso 0 dist 8.72285 4.40476 4.79564 7.88794 7.38 7.71164 numMergedOcc 0
25 mol 236 unq 0 iso 0 dist 8.20542 9.51001 13.8826 5.66569 10.2557 10.5269 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 6.28023 7.8547 6.75848 9.09967 5.7574 4.84546 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 6.28023 7.8547 6.75848 8.49076 7.23876 13.2618 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 7.47179 9.38187 10.1749 7.26542 5.10722 11.2254 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 7.47179 9.38187 10.1749 7.26542 5.10722 11.2254 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 7.47179 9.38187 10.1749 7.26542 5.10722 11.2254 numMergedOcc 0
