0 mol 26 unq 0 iso 0 dist 8.84763 5.21858 6.46104 10.6287 7.3022 11.0099 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.84763 6.29941 7.36856 10.6287 7.3022 4.74747 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 9.61335 15.1255 9.52474 12.5648 7.60283 7.50515 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 7.98862 4.55576 7.99969 6.13477 4.62858 6.68431 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 5.78878 7.58171 7.99969 4.99112 4.62858 6.68431 numMergedOcc 0
5 mol 32 unq 2 iso 0 dist 7.98414 10.2135 7.99969 6.44894 4.62858 6.68431 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 8.55279 5.83686 6.73347 4.50806 9.2902 5.33688 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 7.63526 11.9454 9.25641 8.05989 7.46994 5.94559 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 6.02731 11.4221 7.56205 7.29999 6.04903 11.7069 numMergedOcc 0
9 mol 62 unq 1 iso 0 dist 6.02731 4.05764 4.74544 7.29999 6.04903 5.49555 numMergedOcc 0
10 mol 67 unq 0 iso 0 dist 5.86118 6.24947 9.49144 8.6915 9.0008 13.2018 numMergedOcc 0
11 mol 67 unq 1 iso 0 dist 5.86118 6.24947 9.49144 5.987 9.77887 5.59327 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 9.73325 11.209 9.72053 13.5529 6.90634 6.01663 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 9.73325 12.8735 7.7949 13.5529 6.90634 12.8559 numMergedOcc 0
14 mol 146 unq 0 iso 0 dist 6.28491 5.15943 8.84535 10.8638 9.44952 14.7359 numMergedOcc 0
15 mol 146 unq 1 iso 0 dist 6.28491 5.67737 8.82188 10.8638 9.44952 7.00857 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 7.91633 5.5847 6.22055 15.2878 9.73927 10.2478 numMergedOcc 0
17 mol 148 unq 1 iso 0 dist 7.91633 10.3708 8.18085 15.2878 9.73927 6.84291 numMergedOcc 0
18 mol 150 unq 0 iso 0 dist 8.11909 5.64485 6.14675 15.4689 9.66129 10.2318 numMergedOcc 0
19 mol 150 unq 1 iso 0 dist 8.11909 10.6142 7.94889 15.4689 9.66129 6.79619 numMergedOcc 0
20 mol 168 unq 0 iso 0 dist 8.80059 14.4671 7.44629 8.27116 7.60254 8.67522 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.89987 7.89844 6.2479 13.7713 9.06217 6.25083 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 9.89987 7.89844 6.2479 9.77651 7.13252 4.77278 numMergedOcc 0
23 mol 181 unq 2 iso 0 dist 9.89987 5.10258 6.22122 13.7713 9.06217 10.5753 numMergedOcc 0
24 mol 181 unq 3 iso 0 dist 9.89987 5.10258 6.22122 9.77651 7.13252 5.88819 numMergedOcc 0
25 mol 181 unq 4 iso 0 dist 9.89987 16.1714 7.99195 13.7713 9.06217 5.86342 numMergedOcc 0
26 mol 181 unq 5 iso 0 dist 9.89987 16.1714 7.99195 9.77651 7.13252 9.14057 numMergedOcc 0
27 mol 181 unq 6 iso 0 dist 9.91457 11.9245 5.94469 9.29611 7.05653 6.7991 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 8.28099 14.6912 7.76163 9.25757 9.84492 10.5203 numMergedOcc 0
29 mol 186 unq 1 iso 0 dist 8.28099 6.15341 8.73217 9.25757 9.84492 11.7299 numMergedOcc 0
30 mol 192 unq 0 iso 0 dist 9.71614 9.58683 8.77999 5.10844 7.33225 5.71262 numMergedOcc 0
31 mol 192 unq 1 iso 0 dist 8.81185 10.9985 8.77999 5.36014 7.33225 5.71262 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 8.70651 9.88635 8.50102 14.7996 7.17337 8.78722 numMergedOcc 0
33 mol 232 unq 1 iso 0 dist 8.70651 5.08111 9.40808 14.7996 7.17337 13.5597 numMergedOcc 0
34 mol 234 unq 0 iso 0 dist 9.45787 5.19951 7.32499 5.04225 7.43663 5.9221 numMergedOcc 0
35 mol 234 unq 1 iso 0 dist 9.45787 5.19951 7.32499 12.3321 7.94068 13.2297 numMergedOcc 0
36 mol 238 unq 0 iso 0 dist 6.38654 6.89249 8.94014 12.2552 7.04753 10.8635 numMergedOcc 0
37 mol 238 unq 1 iso 0 dist 6.38654 9.42382 7.02333 12.2552 7.04753 5.68826 numMergedOcc 0
38 mol 238 unq 2 iso 0 dist 6.38654 11.5722 8.67864 12.2552 7.04753 4.87097 numMergedOcc 0
39 mol 238 unq 3 iso 0 dist 9.77185 9.71057 8.94014 5.27441 7.04753 10.8635 numMergedOcc 0
40 mol 238 unq 4 iso 0 dist 9.77185 4.39154 7.02333 5.27441 7.04753 5.68826 numMergedOcc 0
41 mol 238 unq 5 iso 0 dist 9.77185 6.77956 8.67864 5.27441 7.04753 4.87097 numMergedOcc 0
42 mol 243 unq 0 iso 0 dist 7.24253 6.54531 7.49645 5.32118 7.12785 5.70464 numMergedOcc 0
43 mol 243 unq 1 iso 0 dist 7.24253 6.54531 7.49645 11.4546 6.66959 7.83758 numMergedOcc 0
44 mol 243 unq 2 iso 0 dist 7.24253 11.6229 9.9222 5.32118 7.12785 10.3961 numMergedOcc 0
45 mol 243 unq 3 iso 0 dist 7.24253 11.6229 9.9222 11.4546 6.66959 7.8399 numMergedOcc 0
46 mol 259 unq 0 iso 0 dist 9.98231 6.00315 7.98231 11.4659 8.71497 11.6195 numMergedOcc 0
47 mol 259 unq 1 iso 0 dist 9.98231 5.69584 7.08526 11.4659 8.71497 5.79468 numMergedOcc 0
48 mol 265 unq 0 iso 0 dist 6.99454 5.26386 6.71375 7.27547 5.40318 4.65134 numMergedOcc 0
49 mol 271 unq 0 iso 0 dist 8.97962 10.8708 8.98576 6.75816 5.81266 6.78222 numMergedOcc 0
50 mol 271 unq 1 iso 0 dist 8.97962 12.9071 8.92636 6.75816 5.81266 6.20098 numMergedOcc 0
