0 mol 4 unq 0 iso 0 dist 9.84876 11.9832 8.57798 19.3476 13.8402 9.79054 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 6.1462 4.59751 9.12718 7.27315 12.2505 9.97675 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.00925 4.36784 9.66021 6.84065 7.85915 9.83409 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.84674 7.31875 9.7218 10.9728 5.37947 8.16059 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.38928 6.39496 8.40971 11.6611 7.48351 7.99399 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 6.6146 6.63999 9.46251 10.6625 8.74347 8.39015 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.35633 16.6371 7.59354 10.4739 6.14241 8.87856 numMergedOcc 0
7 mol 108 unq 0 iso 0 dist 9.32474 11.0405 7.84262 18.6512 13.8402 9.24001 numMergedOcc 0
8 mol 108 unq 1 iso 0 dist 8.80334 11.0405 9.29208 18.6512 12.7621 9.24001 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 8.59182 7.92198 9.0224 12.4161 5.07258 9.2046 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 9.71692 11.2206 6.58752 16.8422 7.53325 9.74966 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 9.73708 11.1844 6.62442 16.9933 7.68304 9.87914 numMergedOcc 0
12 mol 165 unq 0 iso 0 dist 8.2197 13.2511 5.5411 13.8532 6.67873 6.31455 numMergedOcc 0
13 mol 178 unq 0 iso 0 dist 6.25455 6.97067 5.71438 10.9544 5.57895 7.08434 numMergedOcc 0
14 mol 178 unq 1 iso 0 dist 8.14441 6.97067 7.69328 10.9544 5.75463 7.08434 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.81136 16.2407 9.03521 14.7239 7.86766 9.64455 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 7.86207 15.8912 9.58724 16.3654 9.61081 4.3362 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 7.57712 6.555 9.58724 12.1736 9.98645 8.58709 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 8.32298 8.78869 9.14768 15.3234 9.96498 8.66222 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 7.62593 6.4556 5.90784 8.27538 6.27118 4.99301 numMergedOcc 0
20 mol 253 unq 0 iso 0 dist 9.58767 5.05272 5.80702 11.8776 7.29241 9.35766 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 8.98346 9.89359 6.75578 12.2372 6.00217 5.65496 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.97411 7.74421 7.66806 11.3862 9.56106 9.26487 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 6.58277 14.5953 8.14167 15.3104 9.55474 6.35457 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 8.42706 15.7187 8.14167 14.6525 9.55474 6.35457 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 8.12204 5.69904 8.14167 11.366 9.55474 6.35457 numMergedOcc 0
26 mol 279 unq 0 iso 0 dist 7.2783 8.57407 8.85972 11.3258 6.45021 8.87355 numMergedOcc 0
27 mol 279 unq 1 iso 0 dist 7.2783 8.57407 8.85972 12.6622 7.26242 8.18179 numMergedOcc 0
28 mol 279 unq 2 iso 0 dist 7.2783 8.57407 8.85972 10.1796 5.08267 9.51355 numMergedOcc 0
