0 mol 9 unq 0 iso 0 dist 6.91948 6.36275 6.51397 12.8905 8.14998 12.8646 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.15677 12.1626 9.7522 12.9455 7.98005 3.30063 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.15677 12.1626 9.7522 14.2359 8.31381 8.44515 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 9.61029 7.53125 9.7522 5.34406 7.98005 3.30063 numMergedOcc 0
4 mol 26 unq 3 iso 0 dist 9.61029 7.53125 9.7522 11.3355 8.31381 8.44515 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 8.2513 10.0786 9.77553 4.38299 9.45756 12.4324 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 7.80757 10.928 9.23023 13.7086 7.91148 15.9532 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 7.80757 10.928 9.23023 10.9209 6.59794 14.6188 numMergedOcc 0
8 mol 78 unq 2 iso 0 dist 7.80757 10.928 9.23023 15.7494 8.34957 15.1992 numMergedOcc 0
9 mol 78 unq 3 iso 0 dist 9.2835 7.59211 9.23023 12.7015 7.91148 15.9532 numMergedOcc 0
10 mol 78 unq 4 iso 0 dist 9.2835 7.59211 9.23023 12.9102 6.59794 14.6188 numMergedOcc 0
11 mol 78 unq 5 iso 0 dist 9.2835 7.59211 9.23023 10.2933 8.34957 15.1992 numMergedOcc 0
12 mol 78 unq 6 iso 0 dist 5.02591 5.13304 9.23023 11.1086 7.91148 15.9532 numMergedOcc 0
13 mol 78 unq 7 iso 0 dist 5.02591 5.13304 9.23023 10.2834 6.59794 14.6188 numMergedOcc 0
14 mol 78 unq 8 iso 0 dist 5.02591 5.13304 9.23023 10.0935 8.34957 15.1992 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.91837 6.05002 8.35636 3.38932 8.11702 3.98588 numMergedOcc 0
16 mol 109 unq 1 iso 0 dist 8.91837 6.05002 8.35636 8.29666 7.44558 12.1455 numMergedOcc 0
17 mol 110 unq 0 iso 0 dist 6.59361 4.88877 9.73174 3.32173 9.10911 6.88119 numMergedOcc 0
18 mol 110 unq 1 iso 0 dist 6.59361 7.46387 9.65418 3.32173 9.10911 9.95216 numMergedOcc 0
19 mol 122 unq 0 iso 0 dist 5.09114 12.0108 9.40018 4.92712 4.42563 12.9961 numMergedOcc 0
20 mol 122 unq 1 iso 0 dist 5.09114 9.14438 6.78949 4.92712 4.42563 6.80573 numMergedOcc 0
21 mol 123 unq 0 iso 0 dist 8.87148 4.81545 8.67193 8.75597 8.111 12.0363 numMergedOcc 0
22 mol 123 unq 1 iso 0 dist 9.26057 9.59867 8.67193 6.36283 8.111 12.0363 numMergedOcc 0
23 mol 143 unq 0 iso 0 dist 8.72463 10.0479 8.30654 10.7652 8.99891 9.81306 numMergedOcc 0
24 mol 167 unq 0 iso 0 dist 4.93984 6.87303 8.14096 7.95112 9.86868 3.86842 numMergedOcc 0
25 mol 167 unq 1 iso 0 dist 4.93984 6.87303 8.14096 4.03388 6.83528 7.27404 numMergedOcc 0
26 mol 167 unq 2 iso 0 dist 4.93984 6.01114 8.43038 7.95112 9.86868 13.2021 numMergedOcc 0
27 mol 167 unq 3 iso 0 dist 4.93984 6.01114 8.43038 4.03388 6.83528 3.92405 numMergedOcc 0
28 mol 167 unq 4 iso 0 dist 4.93984 9.04662 9.87966 7.95112 9.86868 15.8191 numMergedOcc 0
29 mol 167 unq 5 iso 0 dist 4.93984 9.04662 9.87966 4.03388 6.83528 6.18329 numMergedOcc 0
30 mol 196 unq 0 iso 0 dist 6.60651 4.73252 6.25429 7.94541 4.67869 7.96489 numMergedOcc 0
31 mol 197 unq 0 iso 0 dist 6.22696 6.19883 8.3337 7.21941 9.23086 3.70636 numMergedOcc 0
32 mol 197 unq 1 iso 0 dist 8.12158 6.19883 5.41292 7.21941 8.37086 3.70636 numMergedOcc 0
33 mol 218 unq 0 iso 0 dist 5.52981 7.26513 8.5119 8.95992 6.1896 6.03974 numMergedOcc 0
34 mol 218 unq 1 iso 0 dist 5.52981 7.26513 8.5119 6.50485 6.09255 8.65933 numMergedOcc 0
35 mol 265 unq 0 iso 0 dist 5.81421 4.86861 7.04833 3.55274 9.28128 5.76716 numMergedOcc 0
36 mol 266 unq 0 iso 0 dist 9.27588 12.8888 8.59986 5.83809 8.97531 9.9168 numMergedOcc 0
37 mol 292 unq 0 iso 0 dist 5.69465 7.13877 9.20416 7.17049 6.69619 3.64117 numMergedOcc 0
38 mol 292 unq 1 iso 0 dist 5.69465 7.13877 9.20416 7.97171 4.49592 7.30677 numMergedOcc 0
39 mol 292 unq 2 iso 0 dist 5.69465 10.9754 7.53641 7.17049 6.69619 6.97445 numMergedOcc 0
40 mol 292 unq 3 iso 0 dist 5.69465 10.9754 7.53641 7.97171 4.49592 5.33412 numMergedOcc 0
