0 mol 8 unq 0 iso 0 dist 9.11545 12.4359 9.00925 12.928 9.31461 15.5014 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 4.27439 5.0974 5.20237 7.38118 5.68079 5.04712 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 6.79758 12.9465 9.3147 5.09246 9.97466 15.257 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 6.79758 4.48525 9.79426 5.09246 9.97466 4.78277 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 9.83301 8.6764 8.84148 9.67906 7.53194 4.80255 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 8.53459 5.83259 6.79881 4.74723 7.21223 7.71448 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.1747 4.90454 9.35912 11.8271 6.89855 10.749 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 8.60438 4.77259 6.6146 4.3421 8.63446 3.78122 numMergedOcc 0
8 mol 91 unq 0 iso 0 dist 5.22576 5.05933 5.78962 10.358 8.91998 5.4863 numMergedOcc 0
9 mol 91 unq 1 iso 0 dist 8.65409 10.592 5.78962 15.2668 8.91998 5.4863 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 9.83241 8.10347 7.07421 9.45041 4.4077 6.14663 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 9.83241 8.10347 7.07421 5.50122 8.4874 5.32811 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 9.6112 13.4643 6.68364 6.65884 8.10681 9.19685 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 4.4558 4.56997 5.69763 4.99343 7.96463 7.55666 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.12896 8.40223 7.00683 5.86531 9.41594 4.96901 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 9.12896 8.40223 7.00683 8.02399 9.92651 3.72258 numMergedOcc 0
16 mol 204 unq 2 iso 0 dist 8.63667 10.3245 7.00683 7.92458 9.41594 4.96901 numMergedOcc 0
17 mol 204 unq 3 iso 0 dist 8.63667 10.3245 7.00683 12.0632 9.92651 3.72258 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 8.67902 13.4896 9.81136 6.49597 9.59498 9.67136 numMergedOcc 0
19 mol 214 unq 1 iso 0 dist 8.67902 8.50143 7.25293 6.49597 9.59498 4.99827 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 7.04478 5.16822 6.00654 3.34784 7.24545 6.94281 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 9.27225 4.49451 8.97411 6.55101 5.94328 8.9947 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 9.51286 18.6043 9.77392 4.58167 6.48382 16.2409 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 7.47103 5.35253 8.63954 6.4415 6.07843 10.0892 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 7.47103 5.35253 8.63954 13.1272 9.66678 16.8309 numMergedOcc 0
25 mol 285 unq 2 iso 0 dist 7.47103 4.91258 4.74716 6.4415 6.07843 3.97296 numMergedOcc 0
26 mol 285 unq 3 iso 0 dist 7.47103 4.91258 4.74716 13.1272 9.66678 10.6606 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 5.10476 5.38959 8.0661 4.82448 9.49562 5.07231 numMergedOcc 0
