0 mol 0 unq 0 iso 0 dist 8.84413 8.74302 12.5665 7.85319 8.66612 16.0403 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.84413 8.74302 12.5665 10.8257 7.96742 15.3975 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 7.96742 5.55156 11.962 10.8652 8.66612 15.361 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.96742 5.55156 11.962 10.8257 8.84413 16.3722 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 8.82108 7.55723 5.13216 8.43234 9.59745 12.5272 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 6.19218 9.5614 6.83587 6.82018 7.19397 5.55156 numMergedOcc 0
6 mol 0 unq 6 iso 0 dist 7.19397 5.55156 6.83587 6.82018 6.19218 9.5614 numMergedOcc 0
7 mol 7 unq 0 iso 0 dist 9.32945 6.22805 4.57188 17.0748 9.67498 13.9815 numMergedOcc 0
8 mol 12 unq 0 iso 0 dist 5.9021 8.17618 7.58748 6.90032 6.65398 13.2405 numMergedOcc 0
9 mol 38 unq 0 iso 0 dist 5.86243 7.57586 5.39129 9.83024 7.55357 11.7939 numMergedOcc 0
10 mol 38 unq 1 iso 0 dist 7.55357 8.86547 5.29179 9.83024 5.86243 10.3065 numMergedOcc 0
11 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 6.90646 8.14932 8.66921 numMergedOcc 0
12 mol 64 unq 1 iso 0 dist 9.3473 7.02352 9.96083 6.90646 8.14932 12.192 numMergedOcc 0
13 mol 64 unq 2 iso 0 dist 8.14932 8.66921 9.82646 6.90646 9.3473 9.10915 numMergedOcc 0
14 mol 64 unq 3 iso 0 dist 6.17846 8.66921 5.33496 6.36389 6.08228 5.54343 numMergedOcc 0
15 mol 64 unq 4 iso 0 dist 6.17846 8.66921 5.33496 13.347 9.86958 13.7301 numMergedOcc 0
16 mol 64 unq 5 iso 0 dist 6.08228 5.54343 5.33496 6.36389 6.17846 8.66921 numMergedOcc 0
17 mol 64 unq 6 iso 0 dist 6.08228 5.54343 5.33496 12.1186 9.86958 13.7301 numMergedOcc 0
18 mol 64 unq 7 iso 0 dist 9.86958 9.99634 10.8691 13.347 6.17846 16.3435 numMergedOcc 0
19 mol 64 unq 8 iso 0 dist 9.86958 9.99634 10.8691 12.1186 6.08228 12.0432 numMergedOcc 0
20 mol 68 unq 0 iso 0 dist 7.19203 7.14865 9.51008 9.29911 8.8095 13.5752 numMergedOcc 0
21 mol 73 unq 0 iso 0 dist 8.60363 4.24428 10.4402 16.6115 9.27331 16.702 numMergedOcc 0
22 mol 73 unq 1 iso 0 dist 8.60363 6.30194 8.0624 16.6115 9.27331 14.6804 numMergedOcc 0
23 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 9.81157 7.11187 19.211 numMergedOcc 0
24 mol 112 unq 0 iso 0 dist 9.42175 5.81552 9.60908 10.5302 7.02969 11.0565 numMergedOcc 0
25 mol 112 unq 1 iso 0 dist 9.42175 5.81552 9.60908 9.00066 7.02265 11.6825 numMergedOcc 0
26 mol 130 unq 0 iso 0 dist 7.9663 9.05626 9.97628 5.84182 6.54338 12.173 numMergedOcc 0
27 mol 130 unq 1 iso 0 dist 7.9663 9.05626 9.97628 13.2888 7.47653 16.7118 numMergedOcc 0
28 mol 133 unq 0 iso 0 dist 9.6582 5.97805 12.6081 5.13345 7.96689 9.14401 numMergedOcc 0
29 mol 133 unq 1 iso 0 dist 5.17734 5.97805 5.26273 5.13345 4.83134 9.14401 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 6.43585 6.86297 5.43796 11.2035 9.45817 11.0743 numMergedOcc 0
31 mol 186 unq 1 iso 0 dist 9.45817 8.03597 11.9053 11.2035 6.43585 16.5894 numMergedOcc 0
32 mol 210 unq 0 iso 0 dist 6.24111 8.07523 5.82028 4.80965 9.00343 7.56882 numMergedOcc 0
33 mol 210 unq 1 iso 0 dist 6.24111 8.07523 5.82028 6.68286 6.41444 10.5902 numMergedOcc 0
34 mol 210 unq 2 iso 0 dist 9.00343 7.56882 5.82028 4.80965 6.24111 8.07523 numMergedOcc 0
35 mol 210 unq 3 iso 0 dist 9.00343 7.56882 5.82028 9.50065 6.41444 10.5902 numMergedOcc 0
36 mol 210 unq 4 iso 0 dist 8.60412 8.07523 4.62641 4.80965 7.05535 7.56882 numMergedOcc 0
37 mol 210 unq 5 iso 0 dist 7.05535 7.56882 4.62641 4.80965 8.60412 8.07523 numMergedOcc 0
38 mol 219 unq 0 iso 0 dist 4.67452 8.09769 10.0509 8.93116 9.86916 16.9289 numMergedOcc 0
39 mol 219 unq 1 iso 0 dist 4.67452 7.24832 5.48556 8.93116 9.86916 14.6122 numMergedOcc 0
40 mol 223 unq 0 iso 0 dist 9.14789 9.94212 19.0281 9.20811 8.78739 17.4992 numMergedOcc 0
41 mol 223 unq 1 iso 0 dist 9.14789 7.34316 11.2364 9.20811 8.78739 14.0059 numMergedOcc 0
42 mol 223 unq 2 iso 0 dist 7.80764 9.94212 4.67731 7.75335 6.03408 9.52613 numMergedOcc 0
43 mol 223 unq 3 iso 0 dist 7.80764 7.34316 11.4951 7.75335 6.03408 14.2677 numMergedOcc 0
44 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 11.1434 7.47122 13.3678 numMergedOcc 0
45 mol 224 unq 1 iso 0 dist 9.08719 7.04127 7.85135 11.1019 5.97988 11.2702 numMergedOcc 0
46 mol 230 unq 0 iso 0 dist 6.88683 8.33847 6.87235 5.96129 7.43793 9.12305 numMergedOcc 0
47 mol 230 unq 1 iso 0 dist 7.43793 9.12305 6.87235 5.96129 6.88683 8.33847 numMergedOcc 0
48 mol 230 unq 2 iso 0 dist 7.43793 9.30906 5.4427 5.96129 6.88683 10.6587 numMergedOcc 0
49 mol 231 unq 0 iso 0 dist 7.28719 9.98232 5.3251 4.23678 6.60684 10.174 numMergedOcc 0
50 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 4.22519 7.76477 11.026 numMergedOcc 0
51 mol 232 unq 1 iso 0 dist 5.92175 7.47238 4.90814 9.1904 6.82688 10.8093 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 5.25969 8.73077 11.4871 numMergedOcc 0
53 mol 261 unq 0 iso 0 dist 9.70222 7.6414 11.544 6.43452 9.71882 12.8798 numMergedOcc 0
54 mol 265 unq 0 iso 0 dist 9.56472 7.54805 15.4199 12.462 9.50814 13.929 numMergedOcc 0
55 mol 266 unq 0 iso 0 dist 9.58577 7.72749 10.2159 4.67106 9.56469 10.0438 numMergedOcc 0
56 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 10.1431 6.44266 8.3291 numMergedOcc 0
57 mol 274 unq 1 iso 0 dist 7.21004 6.21831 4.97216 10.1431 8.75703 8.3291 numMergedOcc 0
58 mol 274 unq 2 iso 0 dist 6.44266 9.79674 9.61244 10.1431 9.07452 15.0027 numMergedOcc 0
59 mol 274 unq 3 iso 0 dist 6.44266 8.3291 6.57235 10.1431 9.07452 6.21831 numMergedOcc 0
60 mol 274 unq 4 iso 0 dist 8.75703 9.79674 10.7877 10.1431 7.21004 15.0027 numMergedOcc 0
61 mol 274 unq 5 iso 0 dist 8.75703 8.3291 4.97216 10.1431 7.21004 6.21831 numMergedOcc 0
62 mol 279 unq 0 iso 0 dist 5.78017 6.47376 5.34376 6.22487 6.12742 9.6147 numMergedOcc 0
63 mol 279 unq 1 iso 0 dist 6.12742 9.6147 5.34376 6.22487 5.78017 6.47376 numMergedOcc 0
64 mol 280 unq 0 iso 0 dist 7.02503 8.40961 8.10688 6.56107 9.18164 9.42213 numMergedOcc 0
65 mol 280 unq 1 iso 0 dist 9.18164 9.42213 8.10688 6.56107 7.02503 8.40961 numMergedOcc 0
66 mol 285 unq 0 iso 0 dist 8.08495 7.66291 8.39941 7.91838 9.3482 13.5103 numMergedOcc 0
