0 mol 5 unq 0 iso 0 dist 7.15734 6.77563 5.32128 5.2522 9.19117 9.17088 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.31149 8.17898 7.59626 8.17747 14.4288 9.30471 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.26685 6.53817 11.7814 11.2244 19.4336 8.58312 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 8.43688 5.66319 9.42379 9.147 14.8069 5.52992 numMergedOcc 0
4 mol 38 unq 0 iso 0 dist 5.86243 7.57586 5.39129 4.54616 9.85636 9.30722 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 7.00677 6.09782 5.29727 9.19015 11.4913 9.20429 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 14.1348 18.3863 8.75668 numMergedOcc 0
7 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 14.7285 18.3863 8.75668 numMergedOcc 0
8 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 14.7285 12.0985 8.75668 numMergedOcc 0
9 mol 64 unq 3 iso 0 dist 6.08228 5.54343 5.33496 8.45243 12.0985 8.75668 numMergedOcc 0
10 mol 64 unq 4 iso 0 dist 9.86958 9.99634 10.8691 15.3613 12.0985 9.64871 numMergedOcc 0
11 mol 68 unq 0 iso 0 dist 8.76389 5.57389 4.62335 8.46933 12.2951 7.89424 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 9.42175 5.81552 9.60908 4.56801 13.1392 9.90769 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 8.48435 8.41848 5.35462 5.61104 9.62885 6.5087 numMergedOcc 0
14 mol 140 unq 0 iso 0 dist 9.92335 9.41832 8.78908 6.00504 13.7147 8.67876 numMergedOcc 0
15 mol 140 unq 1 iso 0 dist 9.92335 5.44596 4.83408 6.00504 13.7147 9.11235 numMergedOcc 0
16 mol 140 unq 2 iso 0 dist 9.92335 9.69069 12.2686 6.00504 13.7147 8.15118 numMergedOcc 0
17 mol 159 unq 0 iso 0 dist 7.60912 8.55431 8.50143 11.1479 11.2013 6.25034 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 8.954 9.42819 8.35998 7.51816 13.0269 7.69229 numMergedOcc 0
19 mol 171 unq 0 iso 0 dist 9.47945 6.01711 5.53673 6.8538 8.95953 7.73971 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 8.20682 7.81237 5.39218 numMergedOcc 0
21 mol 220 unq 1 iso 0 dist 7.35148 7.30244 10.48 17.06 17.5781 9.9693 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 7.62593 4.79841 5.41021 6.16829 12.4841 7.49783 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.74214 7.98022 6.62361 10.558 11.0946 4.80834 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 5.33462 7.98022 5.96552 10.558 10.1147 4.80834 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 9.70222 7.6414 11.544 7.98909 14.4764 7.00833 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 6.12202 9.81087 7.96313 6.75848 9.70022 8.41236 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 8.57035 5.17586 6.03718 7.77606 7.08788 9.24472 numMergedOcc 0
