0 mol 61 unq 0 iso 0 dist 7.28917 7.02173 4.18809 15.8202 9.67403 12.924 14.4616 8.30431 11.8679 8.24748 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 5.58346 9.10386 5.47475 9.96948 9.66744 10.8292 7.53682 5.39171 9.27355 14.7261 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 5.68726 9.78545 6.18163 3.85496 8.31624 13.2899 5.41551 6.328 11.7293 6.15377 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 5.68726 9.78545 6.18163 7.44316 7.46882 9.97998 5.41551 6.328 11.7293 5.54987 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 7.46882 9.97998 6.18163 10.1335 8.31624 13.2899 5.54987 6.328 11.7293 6.15377 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 7.46882 9.97998 6.18163 7.44316 5.68726 9.78545 5.54987 6.328 11.7293 5.41551 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.74364 8.60026 10.1168 4.13723 6.78043 11.6391 4.68995 8.67865 8.40148 8.6267 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 8.9889 9.99089 5.72399 10.3429 6.67575 12.1431 10.1806 7.57822 11.7703 4.36597 numMergedOcc 0
8 mol 103 unq 1 iso 0 dist 6.67575 9.81273 10.0023 10.3429 8.9889 11.4817 4.36597 7.57822 13.595 10.1806 numMergedOcc 0
9 mol 108 unq 0 iso 0 dist 5.52402 7.57593 6.45014 7.80411 6.79804 11.4269 4.2179 9.32474 8.80334 10.5919 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 9.92635 5.83335 14.4206 3.75614 7.85507 7.86724 13.34 6.21267 17.479 9.98606 numMergedOcc 0
11 mol 183 unq 1 iso 0 dist 9.92635 5.83335 14.4206 3.75614 7.85507 7.86724 13.9426 7.41743 19.4773 11.9935 numMergedOcc 0
12 mol 183 unq 2 iso 0 dist 7.85507 9.86506 15.9375 3.75614 9.92635 11.3395 9.98606 6.21267 15.8614 13.34 numMergedOcc 0
13 mol 183 unq 3 iso 0 dist 7.85507 9.86506 15.9375 3.75614 9.92635 11.3395 11.9935 7.41743 20.7227 13.9426 numMergedOcc 0
14 mol 183 unq 4 iso 0 dist 7.85507 7.86724 14.4206 3.75614 9.92635 5.83335 9.98606 6.21267 17.479 13.34 numMergedOcc 0
15 mol 183 unq 5 iso 0 dist 7.85507 7.86724 14.4206 3.75614 9.92635 5.83335 11.9935 7.41743 19.4773 13.9426 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 5.79753 8.47576 5.42954 10.6986 7.56537 12.5846 12.1167 8.51118 11.6998 5.79567 numMergedOcc 0
17 mol 197 unq 1 iso 0 dist 7.56537 9.89975 7.28269 10.6986 5.79753 12.1601 5.79567 8.51118 6.5 12.1167 numMergedOcc 0
18 mol 245 unq 0 iso 0 dist 6.58637 5.48167 6.22658 4.13941 8.91609 9.44131 5.43086 6.41862 8.69377 6.62389 numMergedOcc 0
19 mol 245 unq 1 iso 0 dist 6.58637 5.48167 6.22658 4.13941 8.91609 9.44131 8.73552 9.85927 12.8794 5.74952 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 7.97113 5.22111 4.70261 5.25523 8.38479 8.53598 6.92619 8.91916 4.55368 11.3266 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 5.22111 7.97113 4.70261 5.25523 8.53598 8.38479 9.98638 9.45077 12.6314 12.9823 numMergedOcc 0
22 mol 259 unq 2 iso 0 dist 5.22111 7.97113 4.70261 5.25523 8.53598 8.38479 6.92619 4.55368 8.91916 11.3266 numMergedOcc 0
23 mol 259 unq 3 iso 0 dist 8.38479 8.53598 4.70261 5.25523 7.97113 5.22111 11.3266 8.91916 4.55368 6.92619 numMergedOcc 0
24 mol 259 unq 4 iso 0 dist 8.53598 8.38479 4.70261 5.25523 5.22111 7.97113 12.9823 9.45077 12.6314 9.98638 numMergedOcc 0
25 mol 259 unq 5 iso 0 dist 8.53598 8.38479 4.70261 5.25523 5.22111 7.97113 11.3266 4.55368 8.91916 6.92619 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 3.90274 7.49024 9.45269 6.47501 9.33447 10.4329 5.01049 5.28417 12.4971 7.61055 numMergedOcc 0
27 mol 280 unq 0 iso 0 dist 7.10723 8.01368 9.14734 9.41086 6.8664 15.1358 9.13465 7.02503 12.2852 7.59724 numMergedOcc 0
28 mol 280 unq 1 iso 0 dist 7.10723 8.01368 9.14734 9.41086 6.8664 15.1358 14.2183 9.18164 16.9688 7.88431 numMergedOcc 0
