0 mol 7 unq 0 iso 0 dist 7.32392 15.5277 9.60499 10.5949 6.7985 6.55304 10.1204 9.0379 10.6581 9.68596 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.15434 11.2706 7.10621 10.7937 8.72114 13.8829 12.8628 11.8172 18.3807 6.02702 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 4.92734 7.35767 8.96553 7.97177 8.53529 4.36226 13.8619 12.4076 10.9634 7.03958 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 4.92734 7.35767 8.96553 7.97177 8.53529 4.36226 6.57999 8.4069 9.62879 7.18019 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 4.92734 7.35767 8.96553 7.97177 8.53529 4.36226 12.3088 12.9016 12.4058 8.44009 numMergedOcc 0
5 mol 8 unq 3 iso 0 dist 6.4754 7.06064 9.62879 5.3298 7.18019 4.36226 10.2567 10.9495 10.9634 7.03958 numMergedOcc 0
6 mol 8 unq 4 iso 0 dist 6.4754 7.06064 9.62879 5.3298 7.18019 4.36226 11.9453 8.4069 8.96553 8.53529 numMergedOcc 0
7 mol 8 unq 5 iso 0 dist 6.4754 7.06064 9.62879 5.3298 7.18019 4.36226 7.3795 6.23795 12.4058 8.44009 numMergedOcc 0
8 mol 8 unq 6 iso 0 dist 6.57999 7.35767 9.62879 7.97177 7.18019 4.36226 13.8619 10.9495 10.9634 7.03958 numMergedOcc 0
9 mol 8 unq 7 iso 0 dist 6.57999 7.35767 9.62879 7.97177 7.18019 4.36226 4.92734 8.4069 8.96553 8.53529 numMergedOcc 0
10 mol 8 unq 8 iso 0 dist 6.57999 7.35767 9.62879 7.97177 7.18019 4.36226 12.3088 6.23795 12.4058 8.44009 numMergedOcc 0
11 mol 16 unq 0 iso 0 dist 8.4361 5.39064 4.86568 5.06195 6.62144 5.39089 9.59256 10.6922 11.8757 7.47858 numMergedOcc 0
12 mol 16 unq 1 iso 0 dist 8.59049 5.70228 4.7319 5.11248 6.72833 6.51133 8.82587 10.4852 11.6856 6.93532 numMergedOcc 0
13 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 13.4836 8.60554 8.52463 15.5985 14.6259 15.5324 8.4051 numMergedOcc 0
14 mol 24 unq 1 iso 0 dist 8.20058 16.6906 8.86116 13.4836 8.60554 8.52463 17.2959 10.0952 6.86014 7.29868 numMergedOcc 0
15 mol 24 unq 2 iso 0 dist 8.20058 16.6906 8.86116 9.04355 9.44691 13.4893 15.5985 14.6259 15.5324 8.75662 numMergedOcc 0
16 mol 24 unq 3 iso 0 dist 8.20058 14.9411 8.38394 13.4836 8.60554 12.3994 15.5985 14.6259 17.8264 8.4051 numMergedOcc 0
17 mol 24 unq 4 iso 0 dist 8.20058 14.9411 8.38394 13.4836 8.60554 12.3994 17.2959 10.0952 12.5077 7.29868 numMergedOcc 0
18 mol 24 unq 5 iso 0 dist 8.20058 14.9411 8.38394 9.04355 9.44691 12.505 15.5985 14.6259 17.8264 8.75662 numMergedOcc 0
19 mol 25 unq 0 iso 0 dist 6.23095 10.747 7.31767 12.1434 8.6653 5.64303 11.9439 10.6808 12.4135 7.92503 numMergedOcc 0
20 mol 25 unq 1 iso 0 dist 6.23095 11.5983 6.03987 12.1434 8.6653 5.82503 11.9439 10.6808 11.6743 7.92503 numMergedOcc 0
21 mol 25 unq 2 iso 0 dist 9.22151 4.96681 7.57578 6.63966 8.50222 6.08585 14.305 15.5644 11.9561 8.87757 numMergedOcc 0
22 mol 25 unq 3 iso 0 dist 9.22151 4.96681 7.57578 6.63966 8.50222 6.08585 6.22122 4.33106 7.17969 7.55264 numMergedOcc 0
23 mol 25 unq 4 iso 0 dist 6.22122 4.96681 7.17969 6.63966 7.55264 6.08585 14.305 16.1048 11.9561 8.87757 numMergedOcc 0
24 mol 25 unq 5 iso 0 dist 6.22122 4.96681 7.17969 6.63966 7.55264 6.08585 9.22151 4.33106 7.57578 8.50222 numMergedOcc 0
25 mol 100 unq 0 iso 0 dist 8.22596 5.11615 8.87449 6.21679 7.80975 7.97897 12.2079 10.8586 10.9461 7.10378 numMergedOcc 0
26 mol 100 unq 1 iso 0 dist 5.70279 5.92158 7.47343 10.838 8.30845 12.2861 11.3277 5.88134 12.0662 7.01812 numMergedOcc 0
27 mol 100 unq 2 iso 0 dist 5.70279 5.85449 6.65086 10.838 8.30845 5.80144 11.3277 5.88134 9.60661 7.01812 numMergedOcc 0
28 mol 100 unq 3 iso 0 dist 5.70279 7.68675 6.56369 10.838 8.30845 10.0456 11.3277 5.88134 9.35224 7.01812 numMergedOcc 0
29 mol 100 unq 4 iso 0 dist 5.70279 9.53223 9.30209 10.838 8.30845 6.70236 11.3277 5.88134 10.5853 7.01812 numMergedOcc 0
30 mol 119 unq 0 iso 0 dist 8.62648 4.6251 8.73993 9.25614 6.52773 7.20179 11.5266 4.85907 10.3704 9.11344 numMergedOcc 0
31 mol 125 unq 0 iso 0 dist 6.03557 5.14495 8.62381 6.46489 7.73435 7.43922 10.231 5.20403 12.7528 8.76789 numMergedOcc 0
32 mol 125 unq 1 iso 0 dist 6.03557 5.14495 8.62381 8.27647 9.3778 11.0769 10.231 5.20403 12.7528 9.08382 numMergedOcc 0
33 mol 125 unq 2 iso 0 dist 6.03557 5.14495 8.62381 8.27647 9.3778 11.0769 13.084 11.8325 17.1992 7.47069 numMergedOcc 0
34 mol 133 unq 0 iso 0 dist 9.79004 10.0277 7.24514 13.2968 7.71248 4.34568 14.9707 6.761 9.91388 9.97654 numMergedOcc 0
35 mol 133 unq 1 iso 0 dist 9.79004 10.0277 7.24514 13.2968 7.71248 4.34568 16.8376 7.6656 9.52634 6.66772 numMergedOcc 0
36 mol 133 unq 2 iso 0 dist 9.79004 7.33132 8.22656 13.2968 7.71248 10.6025 14.9707 6.761 10.0372 9.97654 numMergedOcc 0
37 mol 133 unq 3 iso 0 dist 9.79004 7.33132 8.22656 13.2968 7.71248 10.6025 16.8376 7.6656 13.4163 6.66772 numMergedOcc 0
38 mol 134 unq 0 iso 0 dist 5.57904 7.41837 6.54501 12.4426 7.80532 7.41674 11.3191 5.79898 9.89303 5.83771 numMergedOcc 0
39 mol 134 unq 1 iso 0 dist 5.57904 6.50005 6.49416 12.4426 7.80532 9.87376 11.3191 5.79898 9.93925 5.83771 numMergedOcc 0
40 mol 156 unq 0 iso 0 dist 9.19499 5.66289 7.44554 5.02458 9.44367 5.4555 7.11647 5.56175 8.94056 7.90267 numMergedOcc 0
41 mol 156 unq 1 iso 0 dist 9.19499 5.66289 7.44554 15.8724 9.47433 11.9952 14.1844 5.76755 10.4649 6.30021 numMergedOcc 0
42 mol 156 unq 2 iso 0 dist 7.11647 5.59399 7.66148 5.02458 7.90267 6.03934 9.19499 5.56175 12.0598 9.44367 numMergedOcc 0
43 mol 156 unq 3 iso 0 dist 7.11647 5.66289 8.94056 5.02458 7.90267 5.4555 9.19499 5.56175 7.44554 9.44367 numMergedOcc 0
44 mol 181 unq 0 iso 0 dist 8.90247 5.114 9.1374 6.56225 6.2479 6.6251 6.58792 6.01247 9.94371 6.22122 numMergedOcc 0
45 mol 181 unq 1 iso 0 dist 8.90247 5.114 9.1374 6.56225 6.2479 6.6251 10.3907 8.88798 5.98885 7.99195 numMergedOcc 0
46 mol 181 unq 2 iso 0 dist 8.90247 14.0828 8.03334 6.56225 6.2479 7.81713 6.58792 6.01247 10.9639 6.22122 numMergedOcc 0
47 mol 181 unq 3 iso 0 dist 8.90247 14.0828 8.03334 6.56225 6.2479 7.81713 10.3907 8.88798 10.7062 7.99195 numMergedOcc 0
48 mol 231 unq 0 iso 0 dist 8.91036 10.613 7.37839 9.83598 6.98875 6.37275 12.2364 4.06055 8.40182 6.54852 numMergedOcc 0
49 mol 278 unq 0 iso 0 dist 8.83775 4.66992 8.44326 4.36832 8.00673 4.97614 7.58272 8.29447 10.6095 6.62841 numMergedOcc 0
