0 mol 18 unq 0 iso 0 dist 8.25905 4.84965 5.03976 16.1629 9.35863 11.8312 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 8.25905 4.84965 5.03976 6.82841 5.04478 5.34733 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 5.97065 7.62792 9.08976 4.18634 5.84066 7.56492 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.50453 10.3137 5.77643 6.9246 8.38156 8.87768 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 8.50453 10.3137 5.77643 12.5287 7.79336 4.71262 numMergedOcc 0
5 mol 34 unq 2 iso 0 dist 8.50453 10.3137 5.77643 13.6582 7.08559 4.28439 numMergedOcc 0
6 mol 34 unq 3 iso 0 dist 6.74716 6.01297 5.77643 8.09738 8.38156 8.87768 numMergedOcc 0
7 mol 34 unq 4 iso 0 dist 6.74716 6.01297 5.77643 7.48264 7.79336 4.71262 numMergedOcc 0
8 mol 34 unq 5 iso 0 dist 6.74716 6.01297 5.77643 9.18464 7.08559 4.28439 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 4.89196 5.46519 8.74341 7.751 9.1062 12.4494 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 8.94447 8.94648 6.32393 11.2557 5.29949 3.66763 numMergedOcc 0
11 mol 128 unq 0 iso 0 dist 6.12126 5.39332 5.89919 5.61773 6.47811 5.93759 numMergedOcc 0
12 mol 128 unq 1 iso 0 dist 6.12126 10.7242 8.04178 5.61773 6.47811 10.8398 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 4.87879 4.4033 6.33375 8.17498 5.73203 9.88169 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 4.87879 4.4033 6.33375 10.9758 6.57379 11.8593 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 6.76614 9.63434 6.33375 6.6473 5.73203 9.88169 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 6.76614 9.63434 6.33375 10.3627 6.57379 11.8593 numMergedOcc 0
17 mol 134 unq 4 iso 0 dist 8.80672 12.021 6.33375 6.67639 5.73203 9.88169 numMergedOcc 0
18 mol 134 unq 5 iso 0 dist 8.80672 12.021 6.33375 4.4987 6.57379 11.8593 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 6.38872 11.0846 8.6925 5.36933 5.461 6.49084 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 7.83547 5.84294 5.02756 6.70989 8.98681 6.77896 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 6.31342 14.9322 8.94219 4.94099 5.93063 12.3965 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 5.34745 9.27865 7.40764 6.49444 8.24424 5.47357 numMergedOcc 0
23 mol 233 unq 1 iso 0 dist 5.34745 9.27865 7.40764 6.63339 7.0942 5.47592 numMergedOcc 0
24 mol 233 unq 2 iso 0 dist 5.34745 9.27865 7.40764 9.86764 6.01775 3.67394 numMergedOcc 0
25 mol 233 unq 3 iso 0 dist 7.99897 4.98124 7.40764 9.1334 8.24424 5.47357 numMergedOcc 0
26 mol 233 unq 4 iso 0 dist 7.99897 4.98124 7.40764 9.81222 7.0942 5.47592 numMergedOcc 0
27 mol 233 unq 5 iso 0 dist 7.99897 4.98124 7.40764 5.17683 6.01775 3.67394 numMergedOcc 0
28 mol 233 unq 6 iso 0 dist 8.98366 11.6509 7.40764 12.3327 8.24424 5.47357 numMergedOcc 0
29 mol 233 unq 7 iso 0 dist 8.98366 11.6509 7.40764 8.89879 7.0942 5.47592 numMergedOcc 0
30 mol 233 unq 8 iso 0 dist 8.98366 11.6509 7.40764 9.7363 6.01775 3.67394 numMergedOcc 0
31 mol 234 unq 0 iso 0 dist 7.54327 13.9126 6.553 16.363 9.11572 4.84686 numMergedOcc 0
32 mol 235 unq 0 iso 0 dist 9.24964 6.17988 7.79898 9.94369 7.02029 4.23778 numMergedOcc 0
33 mol 235 unq 1 iso 0 dist 5.71896 6.14767 7.79898 7.91326 7.02029 4.23778 numMergedOcc 0
34 mol 235 unq 2 iso 0 dist 8.3229 8.91451 7.79898 5.72513 7.02029 4.23778 numMergedOcc 0
35 mol 238 unq 0 iso 0 dist 9.07397 17.2113 9.13022 13.4501 7.39547 5.6469 numMergedOcc 0
36 mol 238 unq 1 iso 0 dist 8.91763 9.65346 9.13022 8.28104 7.39547 5.6469 numMergedOcc 0
37 mol 267 unq 0 iso 0 dist 6.87713 8.75405 7.08658 5.30771 6.32877 5.77405 numMergedOcc 0
38 mol 267 unq 1 iso 0 dist 6.87713 8.75405 7.08658 7.81198 9.48115 4.1335 numMergedOcc 0
39 mol 267 unq 2 iso 0 dist 6.87713 8.75405 7.08658 14.1912 8.38545 8.68243 numMergedOcc 0
40 mol 267 unq 3 iso 0 dist 6.87713 8.75405 7.08658 10.6273 5.08174 11.0291 numMergedOcc 0
41 mol 267 unq 4 iso 0 dist 6.87713 8.75405 7.08658 11.0675 6.10838 9.75651 numMergedOcc 0
42 mol 267 unq 5 iso 0 dist 6.87713 15.5091 9.18446 5.30771 6.32877 14.8343 numMergedOcc 0
43 mol 267 unq 6 iso 0 dist 6.87713 15.5091 9.18446 7.81198 9.48115 18.2642 numMergedOcc 0
44 mol 267 unq 7 iso 0 dist 6.87713 15.5091 9.18446 14.1912 8.38545 10.1462 numMergedOcc 0
45 mol 267 unq 8 iso 0 dist 6.87713 15.5091 9.18446 10.6273 5.08174 6.43871 numMergedOcc 0
46 mol 267 unq 9 iso 0 dist 6.87713 15.5091 9.18446 11.0675 6.10838 9.03513 numMergedOcc 0
47 mol 267 unq 10 iso 0 dist 6.87713 13.4773 6.60591 5.30771 6.32877 11.9524 numMergedOcc 0
48 mol 267 unq 11 iso 0 dist 6.87713 13.4773 6.60591 7.81198 9.48115 14.5766 numMergedOcc 0
49 mol 267 unq 12 iso 0 dist 6.87713 13.4773 6.60591 14.1912 8.38545 6.09744 numMergedOcc 0
50 mol 267 unq 13 iso 0 dist 6.87713 13.4773 6.60591 10.6273 5.08174 5.40798 numMergedOcc 0
51 mol 267 unq 14 iso 0 dist 6.87713 13.4773 6.60591 11.0675 6.10838 6.6853 numMergedOcc 0
52 mol 267 unq 15 iso 0 dist 8.87518 8.82415 7.08658 11.6034 6.32877 5.77405 numMergedOcc 0
53 mol 267 unq 16 iso 0 dist 8.87518 8.82415 7.08658 12.9552 9.48115 4.1335 numMergedOcc 0
54 mol 267 unq 17 iso 0 dist 8.87518 8.82415 7.08658 5.23612 8.38545 8.68243 numMergedOcc 0
55 mol 267 unq 18 iso 0 dist 8.87518 8.82415 7.08658 10.1261 5.08174 11.0291 numMergedOcc 0
56 mol 267 unq 19 iso 0 dist 8.87518 8.82415 7.08658 9.74815 6.10838 9.75651 numMergedOcc 0
57 mol 267 unq 20 iso 0 dist 8.87518 10.0094 9.18446 11.6034 6.32877 14.8343 numMergedOcc 0
58 mol 267 unq 21 iso 0 dist 8.87518 10.0094 9.18446 12.9552 9.48115 18.2642 numMergedOcc 0
59 mol 267 unq 22 iso 0 dist 8.87518 10.0094 9.18446 5.23612 8.38545 10.1462 numMergedOcc 0
60 mol 267 unq 23 iso 0 dist 8.87518 10.0094 9.18446 10.1261 5.08174 6.43871 numMergedOcc 0
61 mol 267 unq 24 iso 0 dist 8.87518 10.0094 9.18446 9.74815 6.10838 9.03513 numMergedOcc 0
62 mol 267 unq 25 iso 0 dist 8.87518 5.85823 6.60591 11.6034 6.32877 11.9524 numMergedOcc 0
63 mol 267 unq 26 iso 0 dist 8.87518 5.85823 6.60591 12.9552 9.48115 14.5766 numMergedOcc 0
64 mol 267 unq 27 iso 0 dist 8.87518 5.85823 6.60591 5.23612 8.38545 6.09744 numMergedOcc 0
65 mol 267 unq 28 iso 0 dist 8.87518 5.85823 6.60591 10.1261 5.08174 5.40798 numMergedOcc 0
66 mol 267 unq 29 iso 0 dist 8.87518 5.85823 6.60591 9.74815 6.10838 6.6853 numMergedOcc 0
