0 mol 34 unq 0 iso 0 dist 6.85305 6.72467 6.29127 10.0379 13.662 8.55901 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.36645 8.80334 4.84988 4.16088 8.09058 9.54797 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 5.54343 8.61926 5.35421 5.68492 8.68586 8.4517 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.24121 5.29487 11.1718 6.51655 7.04352 9.70189 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 8.52371 5.29487 5.16281 6.51655 10.5996 9.70189 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 6.8198 5.29487 6.26716 6.51655 13.0654 9.70189 numMergedOcc 0
6 mol 71 unq 0 iso 0 dist 8.21553 6.59302 9.06307 11.5433 14.7284 8.47626 numMergedOcc 0
7 mol 71 unq 1 iso 0 dist 8.22762 6.59302 7.31251 11.5433 15.6475 8.47626 numMergedOcc 0
8 mol 94 unq 0 iso 0 dist 9.10488 5.20598 10.0455 7.0184 8.3586 7.38914 numMergedOcc 0
9 mol 94 unq 1 iso 0 dist 9.10488 5.20598 10.0455 6.54023 12.6451 7.0529 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.19156 6.71591 5.37729 5.01204 6.96442 8.87941 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 9.54589 6.71591 8.16165 5.01204 13.2753 8.87941 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.96061 6.61636 12.8483 10.6348 19.5672 9.94276 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 8.96061 6.61636 12.8483 6.47676 14.6509 9.05357 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 8.96061 6.61636 12.8483 6.95294 14.6013 5.99299 numMergedOcc 0
15 mol 140 unq 0 iso 0 dist 9.41832 5.17739 5.58533 6.92517 6.95323 7.49546 numMergedOcc 0
16 mol 140 unq 1 iso 0 dist 5.44596 5.17739 4.6872 6.92517 7.27371 7.49546 numMergedOcc 0
17 mol 140 unq 2 iso 0 dist 9.69069 5.17739 5.5723 6.92517 12.3335 7.49546 numMergedOcc 0
18 mol 140 unq 3 iso 0 dist 8.36882 5.40251 4.90549 7.15311 9.83617 5.63811 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 6.53758 8.54318 5.77564 6.40439 8.87452 6.51096 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 6.53758 8.54318 5.77564 6.76022 7.68368 8.73171 numMergedOcc 0
21 mol 173 unq 0 iso 0 dist 8.70197 7.33162 13.5291 14.5546 21.8707 9.79554 numMergedOcc 0
22 mol 228 unq 0 iso 0 dist 9.4597 4.55699 8.6798 6.24124 12.2721 7.46689 numMergedOcc 0
23 mol 228 unq 1 iso 0 dist 9.4597 8.10816 5.37846 6.24124 12.2721 8.37287 numMergedOcc 0
24 mol 228 unq 2 iso 0 dist 9.29603 7.95486 5.03713 6.22795 11.7433 8.07174 numMergedOcc 0
25 mol 228 unq 3 iso 0 dist 9.29603 4.42593 8.37385 6.22795 11.7433 7.09766 numMergedOcc 0
26 mol 272 unq 0 iso 0 dist 8.82094 6.52635 10.9667 8.27114 13.2416 9.59519 numMergedOcc 0
27 mol 284 unq 0 iso 0 dist 6.86342 6.34235 7.29657 5.13259 7.52785 7.5746 numMergedOcc 0
28 mol 293 unq 0 iso 0 dist 8.78835 7.2668 7.0683 9.52493 14.1306 9.70656 numMergedOcc 0
29 mol 293 unq 1 iso 0 dist 8.78835 7.2668 7.0683 9.50787 12.2011 6.33356 numMergedOcc 0
