0 mol 18 unq 0 iso 0 dist 6.91876 4.66195 4.42115 5.66329 10.3789 8.11835 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.65828 8.36742 4.28862 8.90517 12.5406 8.97754 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 8.48456 8.79638 9.64948 14.8033 15.209 9.2146 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 7.24073 6.42785 10.1805 14.2352 18.206 9.2146 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 8.24422 5.75809 8.89273 6.51818 9.4148 9.2146 numMergedOcc 0
5 mol 28 unq 3 iso 0 dist 8.99724 5.75809 8.10455 6.51818 6.87842 9.2146 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 4.50643 7.07773 9.30664 8.03682 12.4084 7.34832 numMergedOcc 0
7 mol 37 unq 0 iso 0 dist 9.21102 8.5893 12.5114 6.28359 14.8933 9.59073 numMergedOcc 0
8 mol 37 unq 1 iso 0 dist 6.84257 8.5893 6.15909 6.28359 11.4295 9.59073 numMergedOcc 0
9 mol 39 unq 0 iso 0 dist 8.86053 8.82943 10.8914 7.71511 15.4231 8.68887 numMergedOcc 0
10 mol 39 unq 1 iso 0 dist 8.76925 8.82943 13.1234 7.71511 14.5286 8.68887 numMergedOcc 0
11 mol 54 unq 0 iso 0 dist 9.96522 7.62814 4.04498 13.2646 12.687 9.41463 numMergedOcc 0
12 mol 90 unq 0 iso 0 dist 7.94379 8.96446 6.65219 8.53951 12.0429 7.62463 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 7.11476 6.54699 6.43467 10.7386 12.3632 9.33112 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 9.61 8.92048 3.7035 4.21146 8.0732 7.7464 numMergedOcc 0
15 mol 147 unq 1 iso 0 dist 9.61 8.92048 3.7035 8.49014 5.93918 5.12272 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 9.08686 5.78626 3.86041 10.6766 11.9855 9.44964 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.6409 7.62945 5.28021 9.55695 6.84679 9.34653 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.92121 7.14918 11.6389 6.96767 13.2541 7.97504 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 8.51994 7.72276 6.12997 4.1816 10.9344 7.90632 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 7.58907 9.2144 9.21351 9.11127 13.5766 8.06767 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 7.58907 9.2144 9.21351 18.3972 18.8198 9.91087 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 7.58907 9.2144 9.21351 9.11127 13.5766 8.06767 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 7.58907 9.2144 9.21351 18.3972 18.8198 9.91087 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 7.58907 9.2144 9.21351 9.11127 13.5766 8.06767 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 7.58907 9.2144 9.21351 18.3972 18.8198 9.91087 numMergedOcc 0
