0 mol 4 unq 0 iso 0 dist 9.30799 5.65298 9.15878 9.82621 9.63758 7.17837 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 7.15203 7.31459 8.95571 7.39736 9.24055 11.806 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 7.15203 7.31459 8.95571 5.09072 9.66898 12.3757 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.49371 3.98395 8.92491 10.6821 5.73235 8.04327 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 9.49371 3.98395 8.92491 15.7787 7.48127 14.685 numMergedOcc 0
5 mol 76 unq 2 iso 0 dist 9.49371 14.6064 7.41861 10.6821 5.73235 7.7047 numMergedOcc 0
6 mol 76 unq 3 iso 0 dist 9.49371 14.6064 7.41861 15.7787 7.48127 4.00834 numMergedOcc 0
7 mol 76 unq 4 iso 0 dist 5.05941 10.3277 8.92491 10.205 5.73235 8.04327 numMergedOcc 0
8 mol 76 unq 5 iso 0 dist 5.05941 10.3277 8.92491 7.90785 7.48127 14.685 numMergedOcc 0
9 mol 76 unq 6 iso 0 dist 5.05941 9.02965 7.41861 10.205 5.73235 7.7047 numMergedOcc 0
10 mol 76 unq 7 iso 0 dist 5.05941 9.02965 7.41861 7.90785 7.48127 4.00834 numMergedOcc 0
11 mol 76 unq 8 iso 0 dist 9.66942 10.7432 8.92491 13.076 5.73235 8.04327 numMergedOcc 0
12 mol 76 unq 9 iso 0 dist 9.66942 10.7432 8.92491 10.5881 7.48127 14.685 numMergedOcc 0
13 mol 76 unq 10 iso 0 dist 9.66942 10.6763 7.41861 13.076 5.73235 7.7047 numMergedOcc 0
14 mol 76 unq 11 iso 0 dist 9.66942 10.6763 7.41861 10.5881 7.48127 4.00834 numMergedOcc 0
15 mol 83 unq 0 iso 0 dist 9.55654 8.00727 6.77845 15.1565 7.2118 9.39588 numMergedOcc 0
16 mol 83 unq 1 iso 0 dist 9.55654 6.0402 5.48555 15.1565 7.2118 12.0034 numMergedOcc 0
17 mol 83 unq 2 iso 0 dist 9.55654 12.2939 5.39805 15.1565 7.2118 6.61275 numMergedOcc 0
18 mol 99 unq 0 iso 0 dist 7.55765 10.4215 5.61946 10.8479 8.68674 6.02095 numMergedOcc 0
19 mol 103 unq 0 iso 0 dist 8.91952 8.25761 8.23356 6.99545 6.56481 5.86578 numMergedOcc 0
20 mol 129 unq 0 iso 0 dist 5.92115 4.02665 5.16531 10.9159 9.52061 12.2874 numMergedOcc 0
21 mol 132 unq 0 iso 0 dist 6.71787 4.10862 8.72039 4.24969 9.39389 7.53392 numMergedOcc 0
22 mol 136 unq 0 iso 0 dist 9.91448 8.76062 7.65792 4.5433 8.41727 4.65485 numMergedOcc 0
23 mol 136 unq 1 iso 0 dist 7.827 4.90618 7.65792 5.72482 8.41727 4.65485 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 8.39237 6.59916 6.36789 14.8436 6.72718 12.6035 numMergedOcc 0
25 mol 192 unq 0 iso 0 dist 9.96128 7.85772 5.21088 11.3102 7.36571 4.65303 numMergedOcc 0
26 mol 192 unq 1 iso 0 dist 6.69338 7.85772 8.25609 11.3102 9.17137 4.65303 numMergedOcc 0
27 mol 192 unq 2 iso 0 dist 8.1637 12.0152 8.25609 12.0853 9.17137 4.65303 numMergedOcc 0
28 mol 192 unq 3 iso 0 dist 5.91901 14.58 9.78743 5.1382 6.2016 13.2525 numMergedOcc 0
29 mol 230 unq 0 iso 0 dist 8.34367 4.25483 5.19913 9.4788 9.24729 6.28086 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 7.90944 10.9366 4.53228 4.55101 8.26312 10.9464 numMergedOcc 0
31 mol 239 unq 1 iso 0 dist 7.90944 10.9366 4.53228 10.4589 7.58554 6.54316 numMergedOcc 0
32 mol 239 unq 2 iso 0 dist 7.90944 10.3819 8.54078 4.55101 8.26312 10.4394 numMergedOcc 0
33 mol 239 unq 3 iso 0 dist 7.90944 10.3819 8.54078 10.4589 7.58554 6.2497 numMergedOcc 0
34 mol 243 unq 0 iso 0 dist 9.87759 16.5736 9.58608 6.55274 8.78924 14.2074 numMergedOcc 0
35 mol 243 unq 1 iso 0 dist 9.87759 16.5736 9.58608 15.0967 7.70472 5.80426 numMergedOcc 0
36 mol 258 unq 0 iso 0 dist 6.95552 7.98954 8.43002 7.51285 8.57274 6.30651 numMergedOcc 0
37 mol 279 unq 0 iso 0 dist 9.90251 4.02862 9.16172 5.25707 7.83793 6.04816 numMergedOcc 0
