0 mol 15 unq 0 iso 0 dist 5.19544 7.42909 6.88546 5.69927 5.89412 5.63041 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 5.19544 7.42909 6.88546 7.63656 7.07399 13.452 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 5.66743 7.71964 7.96312 9.49066 9.52474 16.3577 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 5.66743 10.066 7.67129 9.49066 9.52474 16.8196 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 7.42669 13.2287 7.96312 4.91484 9.52474 16.3577 numMergedOcc 0
5 mol 27 unq 3 iso 0 dist 7.42669 14.8458 7.67129 4.91484 9.52474 16.8196 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 6.23138 7.89444 9.23947 4.96726 9.97159 5.59762 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 5.51406 6.16048 6.93893 10.2967 9.30539 14.4094 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.18898 4.68995 6.15654 4.52119 6.95572 5.1767 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 7.67331 4.68995 7.89887 4.52119 7.38677 5.1767 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.34823 10.5389 6.67326 5.3154 6.73586 5.81718 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 9.80819 14.6035 7.46919 9.27313 6.22055 9.70656 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 9.80819 14.6035 7.46919 12.8573 8.18085 5.77745 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 9.81665 14.6751 7.36989 9.25213 6.14675 9.69704 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 9.81665 14.6751 7.36989 12.8265 7.94889 5.71213 numMergedOcc 0
15 mol 150 unq 2 iso 0 dist 9.33412 7.47118 8.17805 6.48118 9.24244 9.69704 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 9.37017 9.44575 6.20426 4.04545 8.10214 9.41911 numMergedOcc 0
17 mol 195 unq 0 iso 0 dist 8.80931 7.23085 9.25935 5.90604 7.36683 7.00308 numMergedOcc 0
18 mol 195 unq 1 iso 0 dist 8.80931 7.23085 9.25935 8.97729 9.26504 5.34788 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 8.98598 5.79567 9.87211 4.57437 7.50013 8.58314 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 7.06689 5.79567 6.3997 4.57437 5.81233 8.58314 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 8.62191 4.72843 9.46973 18.2283 9.68728 18.5654 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 8.15381 9.50121 8.2232 5.70669 8.07687 5.37531 numMergedOcc 0
23 mol 206 unq 1 iso 0 dist 8.15381 8.94472 6.07229 5.70669 8.07687 7.78332 numMergedOcc 0
24 mol 220 unq 0 iso 0 dist 7.4513 4.68697 7.46122 8.0303 6.59716 10.6943 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 7.83422 9.592 9.25162 9.60401 9.05071 16.9877 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 8.08939 16.7895 9.97458 11.6777 5.50492 10.5547 numMergedOcc 0
27 mol 244 unq 1 iso 0 dist 7.33574 15.1633 9.97458 7.45211 5.50492 10.5547 numMergedOcc 0
28 mol 292 unq 0 iso 0 dist 6.60049 9.28841 8.67838 6.94727 9.88863 11.3822 numMergedOcc 0
