0 mol 0 unq 0 iso 0 dist 9.16606 6.94181 5.85361 5.47921 11.788 7.15528 10.651 11.9892 7.19817 9.6994 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 5.41248 4.92734 7.36147 7.35767 12.5407 8.96553 6.57999 10.1093 8.4069 9.62879 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 5.41248 6.57999 10.1093 7.35767 12.5407 9.62879 4.92734 7.36147 8.4069 8.96553 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 7.45665 6.4754 4.62402 7.06064 13.0573 9.62879 11.9453 12.9962 8.4069 8.96553 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 7.62469 9.17086 5.39546 5.90113 10.0804 8.80331 10.615 12.2906 8.13395 6.20293 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.29755 6.54183 5.58127 5.65405 9.89662 8.10861 14.4402 17.0633 16.3192 9.5589 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 6.29755 6.54183 5.58127 5.65405 9.89662 8.10861 10.5929 14.1109 14.2075 6.83299 numMergedOcc 0
7 mol 54 unq 2 iso 0 dist 7.4038 6.54183 5.54544 5.65405 11.7963 8.10861 14.4402 20.6345 16.3192 9.5589 numMergedOcc 0
8 mol 54 unq 3 iso 0 dist 7.4038 6.54183 5.54544 5.65405 11.7963 8.10861 10.5929 17.5177 14.2075 6.83299 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.7939 8.16299 7.80518 10.3774 7.23812 8.70481 11.0108 12.8453 14.9342 9.96396 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 6.7939 8.16299 7.80518 10.3774 7.23812 8.70481 10.9082 9.59988 13.3558 6.19304 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 6.85356 8.16299 11.6012 10.3774 10.396 8.70481 11.0108 12.5789 14.9342 9.96396 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 6.85356 8.16299 11.6012 10.3774 10.396 8.70481 10.9082 10.019 13.3558 6.19304 numMergedOcc 0
13 mol 73 unq 4 iso 0 dist 8.44695 8.27015 7.80518 12.6626 7.23812 8.70481 20.562 12.8453 14.9342 9.96396 numMergedOcc 0
14 mol 73 unq 5 iso 0 dist 8.44695 8.27015 7.80518 12.6626 7.23812 8.70481 17.327 9.59988 13.3558 6.19304 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 8.09751 8.96916 12.7068 5.92158 9.27725 6.45675 5.70279 11.3776 5.33144 7.47343 numMergedOcc 0
16 mol 100 unq 1 iso 0 dist 8.09751 8.96916 12.7068 5.92158 9.27725 6.45675 9.71692 5.49021 9.71151 8.86688 numMergedOcc 0
17 mol 100 unq 2 iso 0 dist 8.09751 5.70279 11.3776 5.92158 9.27725 7.47343 8.96916 12.7068 5.33144 6.45675 numMergedOcc 0
18 mol 100 unq 3 iso 0 dist 8.09751 5.70279 11.3776 5.92158 9.27725 7.47343 9.71692 5.49021 10.1407 8.86688 numMergedOcc 0
19 mol 100 unq 4 iso 0 dist 8.09751 5.70279 11.3776 5.85449 13.9516 6.65086 11.3277 17.0696 5.88134 9.60661 numMergedOcc 0
20 mol 100 unq 5 iso 0 dist 8.09751 5.70279 11.3776 7.68675 13.081 6.56369 11.3277 17.0696 5.88134 9.35224 numMergedOcc 0
21 mol 115 unq 0 iso 0 dist 9.47253 8.97043 10.1455 11.8721 17.1394 9.33865 12.9647 14.6132 7.69052 5.83991 numMergedOcc 0
22 mol 115 unq 1 iso 0 dist 9.47253 8.97043 10.1455 5.19652 9.54842 6.11741 12.9647 14.6132 7.69052 7.88312 numMergedOcc 0
23 mol 131 unq 0 iso 0 dist 9.14809 9.33945 14.651 12.3624 19.6719 8.40312 14.2573 19.7431 5.55373 7.12972 numMergedOcc 0
24 mol 131 unq 1 iso 0 dist 9.14809 9.33945 14.651 12.3624 19.6719 8.40312 17.4482 24.713 10.7062 6.85062 numMergedOcc 0
25 mol 131 unq 2 iso 0 dist 6.45169 9.33945 7.47571 12.3624 14.1255 8.40312 14.2573 12.885 5.55373 7.12972 numMergedOcc 0
26 mol 131 unq 3 iso 0 dist 6.45169 9.33945 7.47571 12.3624 14.1255 8.40312 17.4482 16.9757 10.7062 6.85062 numMergedOcc 0
27 mol 142 unq 0 iso 0 dist 7.21779 7.15087 9.15453 8.68855 10.1001 9.2313 10.5719 9.78965 5.50998 7.73169 numMergedOcc 0
28 mol 142 unq 1 iso 0 dist 7.21779 7.15087 9.15453 8.68855 10.1001 9.2313 15.3413 14.227 11.1395 8.96657 numMergedOcc 0
29 mol 142 unq 2 iso 0 dist 7.21779 7.15087 9.15453 5.50176 9.78089 5.31024 10.5719 9.78965 5.50998 7.26382 numMergedOcc 0
30 mol 155 unq 0 iso 0 dist 8.3622 5.68636 8.78324 7.92939 14.5301 6.43582 12.7322 15.7247 7.66392 7.46303 numMergedOcc 0
31 mol 222 unq 0 iso 0 dist 7.99609 8.7419 4.81992 5.01062 7.73634 6.00706 8.5834 9.69122 6.8425 7.54212 numMergedOcc 0
32 mol 222 unq 1 iso 0 dist 7.99609 8.5834 9.69122 5.01062 7.73634 7.54212 8.7419 4.81992 6.8425 6.00706 numMergedOcc 0
33 mol 224 unq 0 iso 0 dist 8.18749 9.73411 11.2298 9.81806 14.526 6.57273 10.1632 10.5034 5.0744 6.60589 numMergedOcc 0
34 mol 224 unq 1 iso 0 dist 8.18749 9.73411 11.2298 5.99647 10.0508 5.78342 10.1632 10.5034 5.0744 9.16166 numMergedOcc 0
35 mol 224 unq 2 iso 0 dist 8.18749 9.73411 11.2298 5.99647 10.0508 5.78342 7.75485 5.95421 5.60236 5.81334 numMergedOcc 0
36 mol 224 unq 3 iso 0 dist 8.18749 7.75485 5.95421 5.99647 10.0508 5.81334 9.73411 11.2298 5.60236 5.78342 numMergedOcc 0
37 mol 224 unq 4 iso 0 dist 8.18749 7.75485 5.95421 5.99647 10.0508 5.81334 10.1632 10.5034 6.91102 9.16166 numMergedOcc 0
38 mol 229 unq 0 iso 0 dist 6.86281 8.8557 11.8327 5.65373 11.2048 8.22528 5.00457 6.36273 5.57838 7.03423 numMergedOcc 0
39 mol 229 unq 1 iso 0 dist 6.86281 5.00457 6.36273 5.65373 11.2048 7.03423 8.8557 11.8327 5.57838 8.22528 numMergedOcc 0
40 mol 238 unq 0 iso 0 dist 7.75366 4.87108 10.3683 7.45873 14.2408 6.22714 7.64276 10.313 5.34096 7.31233 numMergedOcc 0
41 mol 238 unq 1 iso 0 dist 7.75366 7.64276 10.313 7.45873 14.2408 7.31233 4.87108 10.3683 5.34096 6.22714 numMergedOcc 0
42 mol 258 unq 0 iso 0 dist 8.73425 8.21585 5.90131 5.13233 9.04358 6.42289 10.7821 8.81588 7.26417 6.60405 numMergedOcc 0
43 mol 258 unq 1 iso 0 dist 9.65711 8.21585 4.51422 5.13233 10.0455 6.42289 10.7821 11.1234 7.26417 6.60405 numMergedOcc 0
