0 mol 7 unq 0 iso 0 dist 9.58865 7.32392 8.54694 10.5949 13.0255 6.7985 10.1204 6.3027 9.0379 9.68596 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.0323 7.15434 5.70161 10.7937 10.0459 8.72114 12.8628 10.1919 11.8172 6.02702 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.65729 8.4361 5.64581 5.06195 9.26933 6.62144 9.59256 12.2118 10.6922 7.47858 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 9.72314 9.28932 10.6695 5.2347 12.1438 7.12365 6.83481 6.40527 5.34368 8.1284 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 9.72314 6.83481 6.40527 5.2347 12.1438 8.1284 9.28932 10.6695 5.34368 7.12365 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 8.87856 5.85841 6.83826 4.81103 4.94406 5.78706 11.1652 5.0289 7.51619 7.23884 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 8.87856 5.85841 6.83826 4.81103 4.94406 5.78706 7.00285 9.94628 10.6225 5.59328 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 8.87856 5.85841 6.83826 4.81103 4.94406 5.78706 11.8527 7.53156 12.7411 7.5242 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 8.87856 7.00285 9.94628 4.81103 4.94406 5.59328 5.85841 6.83826 10.6225 5.78706 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 8.87856 7.00285 9.94628 4.81103 4.94406 5.59328 11.1652 5.0289 11.4338 7.23884 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 8.87856 7.00285 9.94628 4.81103 4.94406 5.59328 11.8527 7.53156 7.72877 7.5242 numMergedOcc 0
11 mol 98 unq 6 iso 0 dist 6.2491 5.85841 9.30656 4.81103 7.2337 5.78706 11.1652 12.1337 7.51619 7.23884 numMergedOcc 0
12 mol 98 unq 7 iso 0 dist 6.2491 5.85841 9.30656 4.81103 7.2337 5.78706 7.00285 5.39087 10.6225 5.59328 numMergedOcc 0
13 mol 98 unq 8 iso 0 dist 6.2491 5.85841 9.30656 4.81103 7.2337 5.78706 11.8527 12.2431 12.7411 7.5242 numMergedOcc 0
14 mol 98 unq 9 iso 0 dist 6.2491 7.00285 5.39087 4.81103 7.2337 5.59328 5.85841 9.30656 10.6225 5.78706 numMergedOcc 0
15 mol 98 unq 10 iso 0 dist 6.2491 7.00285 5.39087 4.81103 7.2337 5.59328 11.1652 12.1337 11.4338 7.23884 numMergedOcc 0
16 mol 98 unq 11 iso 0 dist 6.2491 7.00285 5.39087 4.81103 7.2337 5.59328 11.8527 12.2431 7.72877 7.5242 numMergedOcc 0
17 mol 98 unq 12 iso 0 dist 3.59451 6.78839 9.30656 7.22196 7.2337 5.78706 11.1321 12.1337 7.51619 7.23884 numMergedOcc 0
18 mol 98 unq 13 iso 0 dist 3.59451 6.78839 9.30656 7.22196 7.2337 5.78706 8.02354 5.39087 10.6225 5.59328 numMergedOcc 0
19 mol 98 unq 14 iso 0 dist 3.59451 6.78839 9.30656 7.22196 7.2337 5.78706 13.7128 12.2431 12.7411 7.5242 numMergedOcc 0
20 mol 98 unq 15 iso 0 dist 3.59451 8.02354 5.39087 7.22196 7.2337 5.59328 6.78839 9.30656 10.6225 5.78706 numMergedOcc 0
21 mol 98 unq 16 iso 0 dist 3.59451 8.02354 5.39087 7.22196 7.2337 5.59328 11.1321 12.1337 11.4338 7.23884 numMergedOcc 0
22 mol 98 unq 17 iso 0 dist 3.59451 8.02354 5.39087 7.22196 7.2337 5.59328 13.7128 12.2431 7.72877 7.5242 numMergedOcc 0
23 mol 125 unq 0 iso 0 dist 6.6081 7.76202 6.92879 7.74181 9.2657 7.47069 13.6357 9.67381 9.34412 9.08382 numMergedOcc 0
24 mol 125 unq 1 iso 0 dist 6.6081 7.76202 6.92879 7.74181 9.2657 7.47069 13.0388 9.19339 11.8325 9.3778 numMergedOcc 0
25 mol 125 unq 2 iso 0 dist 9.64304 6.03557 9.19339 6.46489 11.5759 7.73435 10.231 9.67381 5.20403 8.76789 numMergedOcc 0
26 mol 125 unq 3 iso 0 dist 9.64304 6.03557 9.19339 8.27647 9.2657 9.3778 10.231 9.67381 5.20403 9.08382 numMergedOcc 0
27 mol 125 unq 4 iso 0 dist 9.64304 6.03557 9.19339 8.27647 9.2657 9.3778 13.084 6.92879 11.8325 7.47069 numMergedOcc 0
28 mol 141 unq 0 iso 0 dist 8.51265 9.47675 10.4653 9.00056 8.35864 9.97343 16.9141 15.1845 11.4307 9.70413 numMergedOcc 0
29 mol 156 unq 0 iso 0 dist 6.67598 9.19499 5.0966 5.02458 9.6281 9.44367 7.11647 5.75141 5.56175 7.90267 numMergedOcc 0
30 mol 156 unq 1 iso 0 dist 6.67598 9.19499 5.0966 15.8724 10.9903 9.47433 14.1844 9.97803 5.76755 6.30021 numMergedOcc 0
31 mol 156 unq 2 iso 0 dist 6.67598 7.11647 5.75141 5.02458 9.6281 7.90267 9.19499 5.0966 5.56175 9.44367 numMergedOcc 0
32 mol 156 unq 3 iso 0 dist 8.98636 9.19499 8.58765 5.02458 12.1713 9.44367 7.11647 5.6208 5.56175 7.90267 numMergedOcc 0
33 mol 156 unq 4 iso 0 dist 8.98636 9.19499 8.58765 15.8724 15.6251 9.47433 14.1844 13.8782 5.76755 6.30021 numMergedOcc 0
34 mol 156 unq 5 iso 0 dist 8.98636 7.11647 5.6208 5.02458 12.1713 7.90267 9.19499 8.58765 5.56175 9.44367 numMergedOcc 0
35 mol 156 unq 6 iso 0 dist 8.79185 9.19499 9.07974 5.02458 6.22667 9.44367 7.11647 5.70205 5.56175 7.90267 numMergedOcc 0
36 mol 156 unq 7 iso 0 dist 8.79185 9.19499 9.07974 15.8724 18.2332 9.47433 14.1844 13.5149 5.76755 6.30021 numMergedOcc 0
37 mol 156 unq 8 iso 0 dist 8.79185 7.11647 5.70205 5.02458 6.22667 7.90267 9.19499 9.07974 5.56175 9.44367 numMergedOcc 0
38 mol 181 unq 0 iso 0 dist 8.03259 8.90247 6.94401 6.56225 10.0499 6.2479 6.58792 5.07895 6.01247 6.22122 numMergedOcc 0
39 mol 181 unq 1 iso 0 dist 8.03259 8.90247 6.94401 6.56225 10.0499 6.2479 10.3907 13.9623 8.88798 7.99195 numMergedOcc 0
40 mol 181 unq 2 iso 0 dist 8.03259 6.58792 5.07895 6.56225 10.0499 6.22122 8.90247 6.94401 6.01247 6.2479 numMergedOcc 0
41 mol 181 unq 3 iso 0 dist 8.03259 6.58792 5.07895 6.56225 10.0499 6.22122 10.3907 13.9623 12.6324 7.99195 numMergedOcc 0
42 mol 231 unq 0 iso 0 dist 6.73226 8.91036 11.548 9.83598 13.9215 6.98875 12.2364 14.4653 4.06055 6.54852 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 8.26695 5.82876 12.0757 4.48276 10.2662 7.46394 12.6563 17.6151 10.501 9.45514 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 8.26695 5.82876 12.0757 4.48276 10.2662 7.46394 12.336 18.4795 14.3919 8.91672 numMergedOcc 0
45 mol 274 unq 2 iso 0 dist 8.26695 5.82876 12.0757 4.48276 10.2662 7.46394 8.71129 16.0765 6.15918 7.1729 numMergedOcc 0
46 mol 274 unq 3 iso 0 dist 8.26695 8.71129 16.0765 4.48276 10.2662 7.1729 5.82876 12.0757 6.15918 7.46394 numMergedOcc 0
47 mol 274 unq 4 iso 0 dist 8.26695 8.71129 16.0765 4.48276 10.2662 7.1729 12.6563 17.6151 6.828 9.45514 numMergedOcc 0
48 mol 274 unq 5 iso 0 dist 8.26695 8.71129 16.0765 4.48276 10.2662 7.1729 12.336 18.4795 10.0083 8.91672 numMergedOcc 0
49 mol 274 unq 6 iso 0 dist 5.59151 5.82876 7.96313 4.48276 9.61642 7.46394 12.6563 16.676 10.501 9.45514 numMergedOcc 0
50 mol 274 unq 7 iso 0 dist 5.59151 5.82876 7.96313 4.48276 9.61642 7.46394 12.336 17.8971 14.3919 8.91672 numMergedOcc 0
51 mol 274 unq 8 iso 0 dist 5.59151 5.82876 7.96313 4.48276 9.61642 7.46394 8.71129 13.1879 6.15918 7.1729 numMergedOcc 0
52 mol 274 unq 9 iso 0 dist 5.59151 8.71129 13.1879 4.48276 9.61642 7.1729 5.82876 7.96313 6.15918 7.46394 numMergedOcc 0
53 mol 274 unq 10 iso 0 dist 5.59151 8.71129 13.1879 4.48276 9.61642 7.1729 12.6563 16.676 6.828 9.45514 numMergedOcc 0
54 mol 274 unq 11 iso 0 dist 5.59151 8.71129 13.1879 4.48276 9.61642 7.1729 12.336 17.8971 10.0083 8.91672 numMergedOcc 0
55 mol 274 unq 12 iso 0 dist 8.17922 5.82876 7.97998 4.48276 8.30714 7.46394 12.6563 12.3018 10.501 9.45514 numMergedOcc 0
56 mol 274 unq 13 iso 0 dist 8.17922 5.82876 7.97998 4.48276 8.30714 7.46394 12.336 9.61244 14.3919 8.91672 numMergedOcc 0
57 mol 274 unq 14 iso 0 dist 8.17922 5.82876 7.97998 4.48276 8.30714 7.46394 8.71129 5.7745 6.15918 7.1729 numMergedOcc 0
58 mol 274 unq 15 iso 0 dist 8.17922 8.71129 5.7745 4.48276 8.30714 7.1729 5.82876 7.97998 6.15918 7.46394 numMergedOcc 0
59 mol 274 unq 16 iso 0 dist 8.17922 8.71129 5.7745 4.48276 8.30714 7.1729 12.6563 12.3018 6.828 9.45514 numMergedOcc 0
60 mol 274 unq 17 iso 0 dist 8.17922 8.71129 5.7745 4.48276 8.30714 7.1729 12.336 9.61244 10.0083 8.91672 numMergedOcc 0
