0 mol 0 unq 0 iso 0 dist 9.23213 6.26831 4.04089 10.3034 6.3267 7.48645 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.33604 7.3915 11.705 4.85329 6.26865 9.07858 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 6.85412 9.78006 7.98363 5.60154 9.29529 8.04924 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 6.33889 9.78006 10.4204 5.60154 7.2199 8.04924 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 6.33889 9.78006 10.4204 4.61049 6.9513 13.1647 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 6.33889 9.78006 10.4204 6.64015 9.16116 16.2486 numMergedOcc 0
6 mol 9 unq 4 iso 0 dist 6.33889 9.78006 10.4204 13.7377 8.47109 14.0657 numMergedOcc 0
7 mol 45 unq 0 iso 0 dist 7.06308 6.06454 5.94047 9.01651 8.59109 11.3961 numMergedOcc 0
8 mol 45 unq 1 iso 0 dist 6.34173 9.44459 5.94047 6.89191 8.59109 11.3961 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 6.46761 7.27383 9.17656 8.74789 6.96494 14.6093 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 6.46761 7.27383 9.17656 6.61756 7.01363 12.8203 numMergedOcc 0
11 mol 58 unq 2 iso 0 dist 7.58407 7.27383 10.8775 14.7581 8.80108 19.5866 numMergedOcc 0
12 mol 58 unq 3 iso 0 dist 7.58407 7.27383 10.8775 8.74789 6.50297 14.6093 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 8.71128 6.34525 14.3491 9.2907 7.36816 14.8944 numMergedOcc 0
14 mol 114 unq 1 iso 0 dist 6.96442 9.7918 7.27945 5.37729 8.87941 13.7547 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 6.93652 6.69515 8.00633 7.57216 6.2135 12.4542 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 6.94688 6.51749 10.4684 8.25067 8.20656 11.1398 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 6.71012 6.51749 12.69 8.25067 9.40622 11.1398 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 6.95408 6.96521 4.05564 7.11879 6.41318 9.68977 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 8.53199 8.06216 5.31559 7.47048 6.75035 9.67381 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 8.53199 5.76954 8.21424 7.47048 6.75035 6.61099 numMergedOcc 0
21 mol 218 unq 2 iso 0 dist 8.53199 6.29511 10.1198 7.47048 6.75035 8.8062 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.19953 8.37597 8.5129 7.67202 4.55996 11.8382 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 9.62609 5.4694 5.23507 8.8709 6.152 7.89801 numMergedOcc 0
24 mol 227 unq 1 iso 0 dist 8.17891 8.38865 5.92529 13.3557 7.95168 7.89801 numMergedOcc 0
25 mol 227 unq 2 iso 0 dist 6.95902 5.4694 5.92529 8.8709 7.95168 7.89801 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 9.5707 7.5366 16.5499 5.56749 8.49841 12.5852 numMergedOcc 0
27 mol 234 unq 1 iso 0 dist 9.5707 7.5366 16.5499 12.1076 9.6101 17.4956 numMergedOcc 0
28 mol 234 unq 2 iso 0 dist 6.16063 9.007 7.54397 5.9221 8.49841 12.0926 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 9.90142 6.66971 5.8333 15.7973 8.70193 13.8085 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 5.9216 6.4398 5.8333 10.438 8.70193 13.8085 numMergedOcc 0
31 mol 272 unq 0 iso 0 dist 7.67853 9.05222 6.3139 5.7074 6.75716 7.35433 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 6.50589 7.4099 12.6784 5.31116 8.49866 11.6675 numMergedOcc 0
33 mol 282 unq 0 iso 0 dist 9.58517 8.0241 5.86276 5.9438 6.73692 6.353 numMergedOcc 0
