0 mol 11 unq 0 iso 0 dist 4.61088 5.96346 6.86684 10.7734 13.8584 7.98326 4.10106 6.54358 6.859 9.74251 14.7815 17.503 10.9183 6.35398 15.1065 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 8.38064 7.07399 4.29582 4.39605 7.48342 6.03257 5.49251 9.84471 6.23015 5.20798 10.6338 11.7498 10.1154 6.42748 8.85174 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.20519 7.75618 4.96411 4.97119 10.741 9.95212 8.7083 11.877 8.54034 9.79414 4.54938 7.34551 9.74255 6.41575 13.0732 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.20519 7.75618 4.96411 4.97119 10.741 9.95212 8.7083 11.877 8.54034 9.79414 6.864 7.07775 7.08342 6.41423 12.2354 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 8.4674 8.40416 9.74255 4.64838 6.41575 9.95212 10.4416 13.0732 8.54034 9.79414 4.51865 5.80928 7.08342 6.41423 12.2354 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 4.54938 7.75618 9.74255 4.97119 6.41575 9.95212 8.7083 13.0732 8.54034 9.79414 6.864 5.80928 7.08342 6.41423 12.2354 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 4.51865 8.40416 7.08342 4.64838 6.41423 9.95212 10.4416 12.2354 8.54034 9.79414 8.4674 5.80928 9.74255 6.41575 13.0732 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 6.864 7.75618 7.08342 4.97119 6.41423 9.95212 8.7083 12.2354 8.54034 9.79414 4.54938 5.80928 9.74255 6.41575 13.0732 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 6.86014 9.01567 8.67951 6.66749 9.41441 4.2121 8.91183 12.5088 6.19899 4.08755 11.0194 11.4989 4.50066 6.73939 5.68215 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 6.86014 9.01567 8.67951 6.66749 9.41441 4.2121 13.0212 15.4457 8.49709 6.86136 11.0194 11.4989 4.50066 6.73939 10.4441 numMergedOcc 0
10 mol 24 unq 2 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 8.91183 12.5088 6.61696 4.08755 11.0194 11.4989 5.11617 6.73939 5.68215 numMergedOcc 0
11 mol 24 unq 3 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 5.69214 7.95042 5.80953 10.0453 11.0194 11.4989 5.11617 6.73939 10.9113 numMergedOcc 0
12 mol 24 unq 4 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 9.88364 10.2862 9.85784 14.6305 15.5324 15.5315 12.176 8.4051 20.8425 numMergedOcc 0
13 mol 24 unq 5 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 9.88364 10.2862 9.85784 14.6305 8.86116 10.0952 14.012 8.60554 18.188 numMergedOcc 0
14 mol 24 unq 6 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 9.78753 11.825 9.87996 14.3224 15.5324 15.5315 12.176 8.4051 19.3627 numMergedOcc 0
15 mol 24 unq 7 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 9.78753 11.825 9.87996 14.3224 8.86116 10.0952 14.012 8.60554 18.4146 numMergedOcc 0
16 mol 24 unq 8 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 14.8647 12.5088 6.61696 4.08755 13.2433 11.4989 5.11617 6.73939 5.68215 numMergedOcc 0
17 mol 24 unq 9 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 5.11636 7.95042 5.80953 10.0453 13.2433 11.4989 5.11617 6.73939 10.9113 numMergedOcc 0
18 mol 24 unq 10 iso 0 dist 8.86116 9.41441 14.012 4.32034 12.9284 8.00171 9.88364 18.188 9.85784 5.70626 6.86014 10.0952 6.66749 7.33768 10.2862 numMergedOcc 0
19 mol 24 unq 11 iso 0 dist 8.86116 9.41441 14.012 4.32034 12.9284 8.00171 9.78753 18.4146 9.87996 5.62738 6.86014 10.0952 6.66749 7.33768 11.825 numMergedOcc 0
20 mol 24 unq 12 iso 0 dist 8.86116 9.41441 14.012 8.67951 13.4393 4.2121 9.88364 18.188 9.85784 11.076 6.86014 10.0952 6.66749 9.01567 10.2862 numMergedOcc 0
21 mol 24 unq 13 iso 0 dist 8.86116 9.41441 14.012 8.67951 13.4393 4.2121 9.78753 18.4146 9.87996 9.68535 6.86014 10.0952 6.66749 9.01567 11.825 numMergedOcc 0
22 mol 24 unq 14 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 9.88364 18.188 9.85784 14.6305 15.5324 14.6259 12.176 8.4051 20.8425 numMergedOcc 0
23 mol 24 unq 15 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 9.88364 18.188 9.85784 14.6305 6.86014 10.0952 6.66749 7.29868 10.2862 numMergedOcc 0
24 mol 24 unq 16 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 9.78753 18.4146 9.87996 14.3224 15.5324 14.6259 12.176 8.4051 19.3627 numMergedOcc 0
25 mol 24 unq 17 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 9.78753 18.4146 9.87996 14.3224 6.86014 10.0952 6.66749 7.29868 11.825 numMergedOcc 0
26 mol 24 unq 18 iso 0 dist 8.38394 8.60554 12.3994 14.012 15.392 6.72323 14.8647 17.9146 6.61696 4.08755 8.86116 6.44287 8.52463 9.41441 12.5088 numMergedOcc 0
27 mol 24 unq 19 iso 0 dist 8.38394 8.60554 12.3994 14.012 15.392 6.72323 14.8647 17.9146 6.61696 4.08755 13.2433 15.4364 5.11617 6.73939 5.68215 numMergedOcc 0
28 mol 24 unq 20 iso 0 dist 8.38394 8.60554 12.3994 14.012 15.392 6.72323 5.11636 10.9819 5.80953 10.0453 8.86116 6.44287 8.52463 9.41441 7.95042 numMergedOcc 0
29 mol 24 unq 21 iso 0 dist 8.38394 8.60554 12.3994 14.012 15.392 6.72323 5.11636 10.9819 5.80953 10.0453 13.2433 15.4364 5.11617 6.73939 10.9113 numMergedOcc 0
30 mol 24 unq 22 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 10.1698 5.68215 6.61696 4.08755 15.5324 11.4989 8.52463 9.41441 12.5088 numMergedOcc 0
31 mol 24 unq 23 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 13.6174 10.9113 5.80953 10.0453 15.5324 11.4989 8.52463 9.41441 7.95042 numMergedOcc 0
32 mol 24 unq 24 iso 0 dist 5.54419 6.73939 12.176 4.50066 9.83002 4.2121 15.4313 20.8425 9.85784 11.076 11.0194 15.5315 6.66749 9.01567 10.2862 numMergedOcc 0
33 mol 24 unq 25 iso 0 dist 5.54419 6.73939 12.176 4.50066 9.83002 4.2121 14.1829 19.3627 9.87996 9.68535 11.0194 15.5315 6.66749 9.01567 11.825 numMergedOcc 0
34 mol 24 unq 26 iso 0 dist 5.54419 6.73939 12.176 11.9112 16.8439 8.00171 15.4313 20.8425 9.85784 5.70626 11.0194 15.5315 6.66749 7.33768 10.2862 numMergedOcc 0
35 mol 24 unq 27 iso 0 dist 5.54419 6.73939 12.176 11.9112 16.8439 8.00171 14.1829 19.3627 9.87996 5.62738 11.0194 15.5315 6.66749 7.33768 11.825 numMergedOcc 0
36 mol 24 unq 28 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 15.4313 20.8425 9.85784 14.6305 11.0194 15.5315 6.66749 7.29868 10.2862 numMergedOcc 0
37 mol 24 unq 29 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 15.4313 20.8425 9.85784 14.6305 13.2433 14.6259 14.012 8.60554 18.188 numMergedOcc 0
38 mol 24 unq 30 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 14.1829 19.3627 9.87996 14.3224 11.0194 15.5315 6.66749 7.29868 11.825 numMergedOcc 0
39 mol 24 unq 31 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 14.1829 19.3627 9.87996 14.3224 13.2433 14.6259 14.012 8.60554 18.4146 numMergedOcc 0
40 mol 24 unq 32 iso 0 dist 7.36323 8.4051 13.2229 12.176 18.673 6.72323 10.1698 17.003 6.61696 4.08755 15.5324 19.2131 8.52463 9.41441 12.5088 numMergedOcc 0
41 mol 24 unq 33 iso 0 dist 7.36323 8.4051 13.2229 12.176 18.673 6.72323 10.1698 17.003 6.61696 4.08755 5.54419 12.3067 5.11617 6.73939 5.68215 numMergedOcc 0
42 mol 24 unq 34 iso 0 dist 7.36323 8.4051 13.2229 12.176 18.673 6.72323 13.6174 16.707 5.80953 10.0453 15.5324 19.2131 8.52463 9.41441 7.95042 numMergedOcc 0
43 mol 24 unq 35 iso 0 dist 7.36323 8.4051 13.2229 12.176 18.673 6.72323 13.6174 16.707 5.80953 10.0453 5.54419 12.3067 5.11617 6.73939 10.9113 numMergedOcc 0
44 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 6.47509 7.05196 5.20109 3.904 12.7009 15.5644 9.34396 8.50222 10.9703 numMergedOcc 0
45 mol 25 unq 1 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 6.47509 7.05196 5.20109 3.904 12.8117 16.1048 10.8498 7.55264 10.3338 numMergedOcc 0
46 mol 25 unq 2 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 4.69295 6.55597 9.16515 4.98822 11.9561 10.9391 6.08585 6.16347 11.037 numMergedOcc 0
47 mol 25 unq 3 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 8.79309 7.07751 9.82987 7.91914 11.9561 10.9391 6.08585 6.16347 13.0315 numMergedOcc 0
48 mol 25 unq 4 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 14.9206 11.008 9.40732 10.9145 11.9561 10.9391 6.08585 6.16347 11.971 numMergedOcc 0
49 mol 25 unq 5 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 13.6145 9.49421 6.53269 9.62058 11.9561 10.9391 6.08585 6.16347 9.48085 numMergedOcc 0
50 mol 25 unq 6 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 5.63212 10.9703 5.20109 3.904 11.9561 15.5644 7.33728 8.87757 7.05196 numMergedOcc 0
51 mol 25 unq 7 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 5.63212 10.9703 5.20109 3.904 7.17969 4.33106 10.8498 7.55264 10.3338 numMergedOcc 0
52 mol 25 unq 8 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 13.2447 11.037 9.16515 4.98822 12.7009 10.9391 5.77929 7.45383 6.55597 numMergedOcc 0
53 mol 25 unq 9 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 11.8139 13.0315 9.82987 7.91914 12.7009 10.9391 5.77929 7.45383 7.07751 numMergedOcc 0
54 mol 25 unq 10 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 6.28979 11.971 9.40732 10.9145 12.7009 10.9391 5.77929 7.45383 11.008 numMergedOcc 0
55 mol 25 unq 11 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 5.18617 9.48085 6.53269 9.62058 12.7009 10.9391 5.77929 7.45383 9.49421 numMergedOcc 0
56 mol 25 unq 12 iso 0 dist 7.57578 8.50222 6.08585 10.5328 13.8469 8.88938 13.2447 11.037 9.16515 13.4321 12.7009 10.9391 5.77929 9.01548 6.55597 numMergedOcc 0
57 mol 25 unq 13 iso 0 dist 7.57578 8.50222 6.08585 10.5328 13.8469 8.88938 11.8139 13.0315 9.82987 9.66912 12.7009 10.9391 5.77929 9.01548 7.07751 numMergedOcc 0
58 mol 25 unq 14 iso 0 dist 7.57578 8.50222 6.08585 10.5328 13.8469 8.88938 6.28979 11.971 9.40732 5.86134 12.7009 10.9391 5.77929 9.01548 11.008 numMergedOcc 0
59 mol 25 unq 15 iso 0 dist 7.57578 8.50222 6.08585 10.5328 13.8469 8.88938 5.18617 9.48085 6.53269 5.38592 12.7009 10.9391 5.77929 9.01548 9.49421 numMergedOcc 0
60 mol 25 unq 16 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 5.63212 10.3338 5.20109 3.904 11.9561 16.1048 7.33728 8.87757 7.05196 numMergedOcc 0
61 mol 25 unq 17 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 5.63212 10.3338 5.20109 3.904 7.57578 4.33106 9.34396 8.50222 10.9703 numMergedOcc 0
62 mol 25 unq 18 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 14.9982 11.037 9.16515 4.98822 12.8117 10.9391 5.77929 7.45383 6.55597 numMergedOcc 0
63 mol 25 unq 19 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 14.1251 13.0315 9.82987 7.91914 12.8117 10.9391 5.77929 7.45383 7.07751 numMergedOcc 0
64 mol 25 unq 20 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 8.41421 11.971 9.40732 10.9145 12.8117 10.9391 5.77929 7.45383 11.008 numMergedOcc 0
65 mol 25 unq 21 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 5.68041 9.48085 6.53269 9.62058 12.8117 10.9391 5.77929 7.45383 9.49421 numMergedOcc 0
66 mol 25 unq 22 iso 0 dist 7.17969 7.55264 6.08585 10.4337 13.8469 8.88938 14.9982 11.037 9.16515 13.4321 12.8117 10.9391 5.77929 9.01548 6.55597 numMergedOcc 0
67 mol 25 unq 23 iso 0 dist 7.17969 7.55264 6.08585 10.4337 13.8469 8.88938 14.1251 13.0315 9.82987 9.66912 12.8117 10.9391 5.77929 9.01548 7.07751 numMergedOcc 0
68 mol 25 unq 24 iso 0 dist 7.17969 7.55264 6.08585 10.4337 13.8469 8.88938 8.41421 11.971 9.40732 5.86134 12.8117 10.9391 5.77929 9.01548 11.008 numMergedOcc 0
69 mol 25 unq 25 iso 0 dist 7.17969 7.55264 6.08585 10.4337 13.8469 8.88938 5.68041 9.48085 6.53269 5.38592 12.8117 10.9391 5.77929 9.01548 9.49421 numMergedOcc 0
70 mol 98 unq 0 iso 0 dist 5.08437 6.65501 4.4057 7.06961 6.7117 6.88901 10.4782 9.81956 8.46823 3.92737 6.10456 8.40073 9.67482 4.47349 7.54889 numMergedOcc 0
71 mol 98 unq 1 iso 0 dist 5.08437 6.65501 4.4057 7.06961 6.7117 6.88901 10.4782 9.81956 8.46823 3.92737 10.1136 10.2427 12.0974 5.65185 7.78931 numMergedOcc 0
72 mol 98 unq 2 iso 0 dist 5.08437 6.65501 4.4057 7.06961 6.7117 6.88901 3.9764 5.10496 4.62494 3.94967 6.10456 8.40073 9.67482 4.47349 5.2571 numMergedOcc 0
73 mol 98 unq 3 iso 0 dist 5.08437 6.65501 4.4057 7.06961 6.7117 6.88901 3.9764 5.10496 4.62494 3.94967 10.1136 10.2427 12.0974 5.65185 8.7497 numMergedOcc 0
74 mol 98 unq 4 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 10.4782 10.8223 8.46823 3.92737 5.08437 9.51923 4.4057 6.7117 9.81956 numMergedOcc 0
75 mol 98 unq 5 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 10.4782 10.8223 8.46823 3.92737 6.10456 9.42358 9.67482 4.47349 7.54889 numMergedOcc 0
76 mol 98 unq 6 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 10.4782 10.8223 8.46823 3.92737 10.1136 13.9786 12.0974 5.65185 7.78931 numMergedOcc 0
77 mol 98 unq 7 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 3.9764 5.92242 4.62494 3.94967 5.08437 9.51923 4.4057 6.7117 5.10496 numMergedOcc 0
78 mol 98 unq 8 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 3.9764 5.92242 4.62494 3.94967 6.10456 9.42358 9.67482 4.47349 5.2571 numMergedOcc 0
79 mol 98 unq 9 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 3.9764 5.92242 4.62494 3.94967 10.1136 13.9786 12.0974 5.65185 8.7497 numMergedOcc 0
80 mol 98 unq 10 iso 0 dist 6.10456 6.65501 9.67482 7.06961 4.47349 6.88901 10.4782 7.54889 8.46823 3.92737 5.08437 8.40073 4.4057 6.7117 9.81956 numMergedOcc 0
81 mol 98 unq 11 iso 0 dist 6.10456 6.65501 9.67482 7.06961 4.47349 6.88901 10.4782 7.54889 8.46823 3.92737 10.1136 5.02887 12.0974 5.65185 7.78931 numMergedOcc 0
82 mol 98 unq 12 iso 0 dist 6.10456 6.65501 9.67482 7.06961 4.47349 6.88901 3.9764 5.2571 4.62494 3.94967 5.08437 8.40073 4.4057 6.7117 5.10496 numMergedOcc 0
83 mol 98 unq 13 iso 0 dist 6.10456 6.65501 9.67482 7.06961 4.47349 6.88901 3.9764 5.2571 4.62494 3.94967 10.1136 5.02887 12.0974 5.65185 8.7497 numMergedOcc 0
84 mol 100 unq 0 iso 0 dist 9.60661 7.01812 5.80144 10.6848 14.8081 9.5057 4.03277 8.91882 6.59691 12.48 10.1489 10.8375 5.42531 7.80975 9.21662 numMergedOcc 0
85 mol 100 unq 1 iso 0 dist 9.60661 7.01812 5.80144 10.6848 14.8081 9.5057 4.03277 8.91882 6.59691 12.48 7.17106 11.5403 8.4128 7.10378 10.5432 numMergedOcc 0
86 mol 100 unq 2 iso 0 dist 7.17106 7.01812 8.4128 10.6848 7.10378 9.5057 4.03277 10.5432 6.59691 12.48 10.1489 10.8586 5.42531 7.80975 9.21662 numMergedOcc 0
87 mol 100 unq 3 iso 0 dist 9.35224 7.01812 10.0456 10.6848 15.2289 9.5057 4.03277 11.5088 6.59691 12.48 10.1489 15.1999 5.42531 7.80975 9.21662 numMergedOcc 0
88 mol 100 unq 4 iso 0 dist 9.35224 7.01812 10.0456 10.6848 15.2289 9.5057 4.03277 11.5088 6.59691 12.48 7.17106 8.87654 8.4128 7.10378 10.5432 numMergedOcc 0
89 mol 100 unq 5 iso 0 dist 7.47343 8.30845 12.2861 15.3454 21.075 9.5057 6.23008 9.76432 6.59691 12.48 13.2001 16.3949 5.42531 7.80975 9.21662 numMergedOcc 0
90 mol 100 unq 6 iso 0 dist 7.47343 8.30845 12.2861 15.3454 21.075 9.5057 6.23008 9.76432 6.59691 12.48 10.5134 17.5254 8.4128 7.10378 10.5432 numMergedOcc 0
91 mol 100 unq 7 iso 0 dist 6.65086 8.30845 5.80144 15.3454 14.8081 9.5057 6.23008 8.91882 6.59691 12.48 13.2001 10.8375 5.42531 7.80975 9.21662 numMergedOcc 0
92 mol 100 unq 8 iso 0 dist 6.65086 8.30845 5.80144 15.3454 14.8081 9.5057 6.23008 8.91882 6.59691 12.48 10.5134 11.5403 8.4128 7.10378 10.5432 numMergedOcc 0
93 mol 100 unq 9 iso 0 dist 6.56369 8.30845 10.0456 15.3454 15.2289 9.5057 6.23008 11.5088 6.59691 12.48 13.2001 15.1999 5.42531 7.80975 9.21662 numMergedOcc 0
94 mol 100 unq 10 iso 0 dist 6.56369 8.30845 10.0456 15.3454 15.2289 9.5057 6.23008 11.5088 6.59691 12.48 10.5134 8.87654 8.4128 7.10378 10.5432 numMergedOcc 0
95 mol 100 unq 11 iso 0 dist 9.30209 8.30845 6.70236 15.3454 12.6004 9.5057 6.23008 11.6812 6.59691 12.48 13.2001 11.2306 5.42531 7.80975 9.21662 numMergedOcc 0
96 mol 100 unq 12 iso 0 dist 9.30209 8.30845 6.70236 15.3454 12.6004 9.5057 6.23008 11.6812 6.59691 12.48 10.5134 8.7812 8.4128 7.10378 10.5432 numMergedOcc 0
97 mol 134 unq 0 iso 0 dist 9.89303 7.69991 4.60632 7.41674 5.83771 6.40575 12.847 13.0242 9.0176 15.0575 6.54501 5.79898 5.71679 7.80532 11.988 numMergedOcc 0
98 mol 134 unq 1 iso 0 dist 6.54501 7.69991 5.71679 7.41674 7.80532 6.40575 12.847 11.988 9.0176 15.0575 9.89303 5.79898 4.60632 5.83771 13.0242 numMergedOcc 0
99 mol 134 unq 2 iso 0 dist 8.94367 6.23142 4.57832 9.87376 10.5252 6.40575 8.06642 7.21868 9.0176 15.0575 9.93925 6.86927 4.60632 5.83771 13.0242 numMergedOcc 0
100 mol 134 unq 3 iso 0 dist 8.94367 6.23142 4.57832 9.87376 10.5252 6.40575 8.06642 7.21868 9.0176 15.0575 6.49416 8.80819 5.71679 7.80532 11.988 numMergedOcc 0
101 mol 134 unq 4 iso 0 dist 6.37586 6.23142 5.29786 9.87376 10.7586 6.40575 8.06642 7.93372 9.0176 15.0575 9.93925 7.11631 4.60632 5.83771 13.0242 numMergedOcc 0
102 mol 134 unq 5 iso 0 dist 6.37586 6.23142 5.29786 9.87376 10.7586 6.40575 8.06642 7.93372 9.0176 15.0575 6.49416 5.00817 5.71679 7.80532 11.988 numMergedOcc 0
103 mol 134 unq 6 iso 0 dist 6.49416 6.23142 5.71679 9.87376 7.80532 6.40575 8.06642 11.988 9.0176 15.0575 9.93925 5.79898 4.60632 5.83771 13.0242 numMergedOcc 0
104 mol 134 unq 7 iso 0 dist 9.86662 9.94764 4.57832 14.9876 10.5252 6.40575 4.00092 7.21868 9.0176 15.0575 14.423 6.86927 4.60632 5.83771 13.0242 numMergedOcc 0
105 mol 134 unq 8 iso 0 dist 9.86662 9.94764 4.57832 14.9876 10.5252 6.40575 4.00092 7.21868 9.0176 15.0575 12.5075 8.80819 5.71679 7.80532 11.988 numMergedOcc 0
106 mol 134 unq 9 iso 0 dist 9.71307 9.94764 5.29786 14.9876 10.7586 6.40575 4.00092 7.93372 9.0176 15.0575 14.423 7.11631 4.60632 5.83771 13.0242 numMergedOcc 0
107 mol 134 unq 10 iso 0 dist 9.71307 9.94764 5.29786 14.9876 10.7586 6.40575 4.00092 7.93372 9.0176 15.0575 12.5075 5.00817 5.71679 7.80532 11.988 numMergedOcc 0
108 mol 181 unq 0 iso 0 dist 8.03334 6.46704 4.43096 7.81713 6.2479 7.32087 6.28125 10.0802 9.06571 5.3698 10.9639 6.01247 6.06566 6.22122 10.0333 numMergedOcc 0
109 mol 181 unq 1 iso 0 dist 8.03334 6.46704 4.43096 7.81713 6.2479 7.32087 6.28125 10.0802 9.06571 5.3698 10.7062 8.88798 12.2164 7.99195 10.9279 numMergedOcc 0
110 mol 181 unq 2 iso 0 dist 8.03334 6.46704 4.43096 7.81713 6.2479 7.32087 6.50233 9.76212 7.35884 6.39406 10.9639 6.01247 6.06566 6.22122 8.59874 numMergedOcc 0
111 mol 181 unq 3 iso 0 dist 8.03334 6.46704 4.43096 7.81713 6.2479 7.32087 6.50233 9.76212 7.35884 6.39406 10.7062 8.88798 12.2164 7.99195 13.2783 numMergedOcc 0
112 mol 181 unq 4 iso 0 dist 8.03334 6.59025 8.04639 7.81713 6.2479 8.86197 6.28125 10.0802 9.88897 5.3698 10.9639 6.01247 13.0409 6.22122 10.0333 numMergedOcc 0
113 mol 181 unq 5 iso 0 dist 8.03334 6.59025 8.04639 7.81713 6.2479 8.86197 6.28125 10.0802 9.88897 5.3698 10.7062 8.88798 5.77299 7.99195 10.9279 numMergedOcc 0
114 mol 181 unq 6 iso 0 dist 7.63312 5.9176 5.63555 6.29863 11.9764 7.22883 10.6474 6.64173 8.12266 14.2282 15.333 18.3341 12.7358 9.72611 18.76 numMergedOcc 0
115 mol 181 unq 7 iso 0 dist 7.63312 5.9176 5.63555 6.29863 11.9764 7.22883 5.12833 9.55105 9.43306 10.273 15.333 18.3341 12.7358 9.72611 18.6809 numMergedOcc 0
116 mol 181 unq 8 iso 0 dist 7.63312 5.9176 5.63555 6.29863 11.9764 7.22883 4.61184 11.7785 8.59681 5.14966 15.333 18.3341 12.7358 9.72611 13.7845 numMergedOcc 0
117 mol 232 unq 0 iso 0 dist 8.27212 9.05071 8.80479 4.9377 9.40808 9.8664 5.42461 10.3021 6.59036 4.68548 10.5803 6.56633 12.3508 8.50102 11.4909 numMergedOcc 0
