0 mol 34 unq 0 iso 0 dist 7.18022 5.32981 7.79336 4.55481 7.01952 4.22398 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.24711 5.32981 7.08559 4.55481 4.58552 4.22398 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 6.24711 8.90278 8.63635 4.55481 4.58552 8.82586 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 7.28228 5.50513 7.11695 5.46827 5.40489 4.06789 numMergedOcc 0
4 mol 53 unq 1 iso 0 dist 7.28228 10.8486 7.58093 5.46827 5.40489 6.57749 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.13108 10.963 9.4866 13.5024 9.59729 4.00608 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.13108 7.18506 9.40363 13.5024 9.59729 11.915 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.76379 5.59971 6.52939 5.09159 8.64934 4.1859 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 9.76379 5.59971 6.52939 10.867 8.7515 8.68431 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 5.56994 6.35364 6.12922 6.09562 7.31064 4.22481 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 6.24825 10.2377 7.65255 6.63111 7.65564 5.65471 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 6.39384 10.7942 8.0168 6.95773 7.65564 5.78043 numMergedOcc 0
12 mol 115 unq 2 iso 0 dist 9.42082 10.9739 8.0168 6.01673 7.65564 5.78043 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 9.10524 14.0644 5.73203 15.3018 8.14226 4.44936 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 9.33094 5.3585 7.43401 8.06642 8.62504 9.48887 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 8.69531 6.74887 7.43401 4.00092 8.62504 9.48887 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 5.35237 8.96357 6.57379 5.4761 5.78982 4.44936 numMergedOcc 0
17 mol 134 unq 4 iso 0 dist 9.00918 5.9915 5.73203 5.03507 8.14226 4.44936 numMergedOcc 0
18 mol 134 unq 5 iso 0 dist 7.99477 5.9915 6.57379 5.03507 5.78982 4.44936 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 5.40637 5.44503 7.46803 4.78563 9.29944 9.4389 numMergedOcc 0
20 mol 146 unq 0 iso 0 dist 9.04757 9.18212 5.41078 8.33152 7.78784 4.23789 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.01624 6.7991 6.76746 5.42158 9.92831 5.82984 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 5.05973 8.35755 6.76746 10.0773 9.92831 5.82984 numMergedOcc 0
23 mol 197 unq 0 iso 0 dist 9.10817 5.2908 9.27218 9.61454 6.69042 12.627 numMergedOcc 0
24 mol 197 unq 1 iso 0 dist 6.86828 6.23998 9.27218 7.59871 6.69042 12.627 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 7.46481 6.67959 8.70987 16.8346 9.43017 17.0808 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 9.12776 8.82861 9.84652 5.71717 4.66186 9.79637 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 9.72188 15.5674 9.84652 10.4706 4.66186 9.79637 numMergedOcc 0
28 mol 272 unq 0 iso 0 dist 6.44147 6.64985 8.84523 4.03396 8.55539 5.46368 numMergedOcc 0
29 mol 273 unq 0 iso 0 dist 6.31969 7.00883 9.06937 10.2693 9.02537 14.7645 numMergedOcc 0
30 mol 284 unq 0 iso 0 dist 9.19921 9.71439 9.69262 11.7046 9.69019 7.10248 numMergedOcc 0
31 mol 284 unq 1 iso 0 dist 6.41303 5.21666 9.69262 7.70187 9.69019 7.10248 numMergedOcc 0
32 mol 292 unq 0 iso 0 dist 9.74118 5.98906 6.1905 5.94 6.22943 6.87619 numMergedOcc 0
33 mol 292 unq 1 iso 0 dist 9.74118 5.98906 6.1905 9.18492 9.31056 11.493 numMergedOcc 0
34 mol 292 unq 2 iso 0 dist 9.46442 12.1551 5.84792 17.5073 9.23612 6.87619 numMergedOcc 0
