0 mol 15 unq 0 iso 0 dist 8.38064 7.48342 4.39605 4.29582 7.07399 6.03257 11.7498 10.6338 6.42748 10.1154 9.84471 5.49251 5.20798 6.23015 8.85174 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.4674 6.41575 4.64838 9.74255 8.40416 9.95212 5.80928 4.51865 6.41423 7.08342 13.0732 10.4416 9.79414 8.54034 12.2354 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 4.54938 6.41575 4.97119 9.74255 7.75618 9.95212 5.80928 6.864 6.41423 7.08342 13.0732 8.7083 9.79414 8.54034 12.2354 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 4.51865 6.41423 4.64838 7.08342 8.40416 9.95212 5.80928 8.4674 6.41575 9.74255 12.2354 10.4416 9.79414 8.54034 13.0732 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 6.864 6.41423 4.97119 7.08342 7.75618 9.95212 5.80928 4.54938 6.41575 9.74255 12.2354 8.7083 9.79414 8.54034 13.0732 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 15.5315 15.5324 8.4051 12.176 10.2862 9.88364 14.6305 9.85784 20.8425 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 15.5315 15.5324 8.4051 12.176 11.825 9.78753 14.3224 9.87996 19.3627 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 10.0952 8.86116 8.60554 14.012 10.2862 9.88364 14.6305 9.85784 18.188 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 10.0952 8.86116 8.60554 14.012 11.825 9.78753 14.3224 9.87996 18.4146 numMergedOcc 0
9 mol 24 unq 4 iso 0 dist 6.86014 9.41441 6.66749 8.67951 9.01567 4.2121 11.4989 11.0194 6.73939 4.50066 12.5088 8.91183 4.08755 6.19899 5.68215 numMergedOcc 0
10 mol 24 unq 5 iso 0 dist 6.86014 9.41441 6.66749 8.67951 9.01567 4.2121 11.4989 11.0194 6.73939 4.50066 15.4457 13.0212 6.86136 8.49709 10.4441 numMergedOcc 0
11 mol 24 unq 6 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 11.4989 11.0194 6.73939 5.11617 12.5088 8.91183 4.08755 6.61696 5.68215 numMergedOcc 0
12 mol 24 unq 7 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 11.4989 11.0194 6.73939 5.11617 7.95042 5.69214 10.0453 5.80953 10.9113 numMergedOcc 0
13 mol 24 unq 8 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 14.6259 15.5324 8.4051 12.176 18.188 9.88364 14.6305 9.85784 20.8425 numMergedOcc 0
14 mol 24 unq 9 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 14.6259 15.5324 8.4051 12.176 18.4146 9.78753 14.3224 9.87996 19.3627 numMergedOcc 0
15 mol 24 unq 10 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 10.0952 6.86014 7.29868 6.66749 18.188 9.88364 14.6305 9.85784 10.2862 numMergedOcc 0
16 mol 24 unq 11 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 10.0952 6.86014 7.29868 6.66749 18.4146 9.78753 14.3224 9.87996 11.825 numMergedOcc 0
17 mol 24 unq 12 iso 0 dist 8.86116 9.44691 13.4893 14.012 9.41441 15.7523 14.6259 15.5324 8.75662 12.176 18.188 9.88364 22.0999 9.85784 20.8425 numMergedOcc 0
18 mol 24 unq 13 iso 0 dist 8.86116 9.44691 13.4893 14.012 9.41441 15.7523 14.6259 15.5324 8.75662 12.176 18.4146 9.78753 20.7997 9.87996 19.3627 numMergedOcc 0
19 mol 24 unq 14 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 11.4989 13.2433 6.73939 5.11617 12.5088 14.8647 4.08755 6.61696 5.68215 numMergedOcc 0
20 mol 24 unq 15 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 11.4989 13.2433 6.73939 5.11617 7.95042 5.11636 10.0453 5.80953 10.9113 numMergedOcc 0
21 mol 24 unq 16 iso 0 dist 8.86116 9.41441 14.012 10.971 8.44664 18.7793 11.4989 13.2433 6.73939 17.1059 12.3058 4.79736 18.0797 9.98592 17.91 numMergedOcc 0
22 mol 24 unq 17 iso 0 dist 8.86116 9.41441 14.012 13.4893 9.44691 15.7523 11.4989 13.2433 6.73939 10.8238 17.9275 14.4081 14.7634 9.586 9.33482 numMergedOcc 0
23 mol 24 unq 18 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 15.5315 11.0194 7.29868 6.66749 20.8425 15.4313 14.6305 9.85784 10.2862 numMergedOcc 0
24 mol 24 unq 19 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 15.5315 11.0194 7.29868 6.66749 19.3627 14.1829 14.3224 9.87996 11.825 numMergedOcc 0
25 mol 24 unq 20 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 14.6259 13.2433 8.60554 14.012 20.8425 15.4313 14.6305 9.85784 18.188 numMergedOcc 0
26 mol 24 unq 21 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 14.6259 13.2433 8.60554 14.012 19.3627 14.1829 14.3224 9.87996 18.4146 numMergedOcc 0
27 mol 24 unq 22 iso 0 dist 5.54419 8.75662 10.8238 12.176 6.73939 15.7523 14.6259 13.2433 9.44691 14.012 20.8425 15.4313 22.0999 9.85784 18.188 numMergedOcc 0
28 mol 24 unq 23 iso 0 dist 5.54419 8.75662 10.8238 12.176 6.73939 15.7523 14.6259 13.2433 9.44691 14.012 19.3627 14.1829 20.7997 9.87996 18.4146 numMergedOcc 0
29 mol 24 unq 24 iso 0 dist 5.54419 8.70827 5.59311 5.11617 8.4051 12.8389 12.3067 7.36323 9.12854 13.2229 5.68215 10.1698 13.7009 6.61696 17.003 numMergedOcc 0
30 mol 24 unq 25 iso 0 dist 5.54419 8.70827 5.59311 5.11617 8.4051 12.8389 12.3067 7.36323 9.12854 13.2229 10.9113 13.6174 18.3168 5.80953 16.707 numMergedOcc 0
31 mol 24 unq 26 iso 0 dist 5.54419 8.70827 5.59311 13.1779 8.23446 11.4596 12.3067 7.36323 9.12854 6.38336 9.16003 5.73029 5.57665 9.33304 10.502 numMergedOcc 0
32 mol 24 unq 27 iso 0 dist 5.54419 8.70827 5.59311 13.1779 8.23446 11.4596 12.3067 7.36323 9.12854 6.38336 10.4135 6.28159 9.86385 4.5711 8.87744 numMergedOcc 0
33 mol 24 unq 28 iso 0 dist 5.54419 8.70827 5.59311 13.1779 8.23446 11.4596 12.3067 7.36323 9.12854 6.38336 9.33482 5.50396 10.4353 4.44526 7.27472 numMergedOcc 0
34 mol 24 unq 29 iso 0 dist 5.54419 8.70827 5.59311 10.8238 8.75662 11.6684 12.3067 7.36323 9.12854 6.7828 9.33482 5.50396 10.4353 9.586 7.27472 numMergedOcc 0
35 mol 24 unq 30 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 11.4989 15.5324 9.41441 8.52463 5.68215 10.1698 4.08755 6.61696 12.5088 numMergedOcc 0
36 mol 24 unq 31 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 11.4989 15.5324 9.41441 8.52463 10.9113 13.6174 10.0453 5.80953 7.95042 numMergedOcc 0
37 mol 24 unq 32 iso 0 dist 5.54419 6.73939 12.176 13.1779 8.23446 19.0465 11.4989 15.5324 9.41441 21.8521 9.16003 5.73029 15.0789 9.33304 20.4195 numMergedOcc 0
38 mol 24 unq 33 iso 0 dist 5.54419 6.73939 12.176 13.1779 8.23446 19.0465 11.4989 15.5324 9.41441 21.8521 10.4135 6.28159 15.9573 4.5711 20.5402 numMergedOcc 0
39 mol 24 unq 34 iso 0 dist 5.54419 6.73939 12.176 13.1779 8.23446 19.0465 11.4989 15.5324 9.41441 21.8521 9.33482 5.50396 14.7634 4.44526 17.9275 numMergedOcc 0
40 mol 24 unq 35 iso 0 dist 5.54419 6.73939 12.176 10.8238 8.75662 15.7523 11.4989 15.5324 9.41441 13.4893 9.33482 5.50396 14.7634 9.586 17.9275 numMergedOcc 0
41 mol 24 unq 36 iso 0 dist 7.36323 9.12854 5.59311 13.2229 8.4051 12.8389 12.3067 5.54419 8.70827 5.11617 17.003 10.1698 13.7009 6.61696 5.68215 numMergedOcc 0
42 mol 24 unq 37 iso 0 dist 7.36323 9.12854 5.59311 13.2229 8.4051 12.8389 12.3067 5.54419 8.70827 5.11617 16.707 13.6174 18.3168 5.80953 10.9113 numMergedOcc 0
43 mol 24 unq 38 iso 0 dist 7.36323 9.12854 5.59311 6.38336 8.23446 11.4596 12.3067 5.54419 8.70827 13.1779 10.502 5.73029 5.57665 9.33304 9.16003 numMergedOcc 0
44 mol 24 unq 39 iso 0 dist 7.36323 9.12854 5.59311 6.38336 8.23446 11.4596 12.3067 5.54419 8.70827 13.1779 8.87744 6.28159 9.86385 4.5711 10.4135 numMergedOcc 0
45 mol 24 unq 40 iso 0 dist 7.36323 9.12854 5.59311 6.38336 8.23446 11.4596 12.3067 5.54419 8.70827 13.1779 7.27472 5.50396 10.4353 4.44526 9.33482 numMergedOcc 0
46 mol 24 unq 41 iso 0 dist 7.36323 9.12854 5.59311 6.7828 8.75662 11.6684 12.3067 5.54419 8.70827 10.8238 7.27472 5.50396 10.4353 9.586 9.33482 numMergedOcc 0
47 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 10.9391 11.9561 6.16347 6.08585 6.55597 4.69295 4.98822 9.16515 11.037 numMergedOcc 0
48 mol 25 unq 1 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 10.9391 11.9561 6.16347 6.08585 7.07751 8.79309 7.91914 9.82987 13.0315 numMergedOcc 0
49 mol 25 unq 2 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 10.9391 11.9561 6.16347 6.08585 11.008 14.9206 10.9145 9.40732 11.971 numMergedOcc 0
50 mol 25 unq 3 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 10.9391 11.9561 6.16347 6.08585 9.49421 13.6145 9.62058 6.53269 9.48085 numMergedOcc 0
51 mol 25 unq 4 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 15.5644 12.7009 8.50222 9.34396 7.05196 6.47509 3.904 5.20109 10.9703 numMergedOcc 0
52 mol 25 unq 5 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 16.1048 12.8117 7.55264 10.8498 7.05196 6.47509 3.904 5.20109 10.3338 numMergedOcc 0
53 mol 25 unq 6 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 10.9391 12.7009 7.45383 5.77929 11.037 13.2447 4.98822 9.16515 6.55597 numMergedOcc 0
54 mol 25 unq 7 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 10.9391 12.7009 7.45383 5.77929 13.0315 11.8139 7.91914 9.82987 7.07751 numMergedOcc 0
55 mol 25 unq 8 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 10.9391 12.7009 7.45383 5.77929 11.971 6.28979 10.9145 9.40732 11.008 numMergedOcc 0
56 mol 25 unq 9 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 10.9391 12.7009 7.45383 5.77929 9.48085 5.18617 9.62058 6.53269 9.49421 numMergedOcc 0
57 mol 25 unq 10 iso 0 dist 7.57578 7.92503 6.11127 6.08585 8.50222 11.4912 10.6808 13.7311 8.6653 16.3984 11.037 13.2447 17.5013 9.16515 20.904 numMergedOcc 0
58 mol 25 unq 11 iso 0 dist 7.57578 7.92503 6.11127 6.08585 8.50222 11.4912 10.6808 13.7311 8.6653 16.3984 13.0315 11.8139 17.4121 9.82987 22.9087 numMergedOcc 0
59 mol 25 unq 12 iso 0 dist 7.57578 7.92503 6.11127 6.08585 8.50222 11.4912 10.6808 13.7311 8.6653 16.3984 11.971 6.28979 12.1404 9.40732 19.9467 numMergedOcc 0
60 mol 25 unq 13 iso 0 dist 7.57578 7.92503 6.11127 6.08585 8.50222 11.4912 10.6808 13.7311 8.6653 16.3984 9.48085 5.18617 10.2758 6.53269 17.8732 numMergedOcc 0
61 mol 25 unq 14 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 15.5644 11.9561 8.87757 7.33728 10.9703 5.63212 3.904 5.20109 7.05196 numMergedOcc 0
62 mol 25 unq 15 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 4.33106 7.17969 7.55264 10.8498 10.9703 5.63212 3.904 5.20109 10.3338 numMergedOcc 0
63 mol 25 unq 16 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 10.9391 12.8117 7.45383 5.77929 11.037 14.9982 4.98822 9.16515 6.55597 numMergedOcc 0
64 mol 25 unq 17 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 10.9391 12.8117 7.45383 5.77929 13.0315 14.1251 7.91914 9.82987 7.07751 numMergedOcc 0
65 mol 25 unq 18 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 10.9391 12.8117 7.45383 5.77929 11.971 8.41421 10.9145 9.40732 11.008 numMergedOcc 0
66 mol 25 unq 19 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 10.9391 12.8117 7.45383 5.77929 9.48085 5.68041 9.62058 6.53269 9.49421 numMergedOcc 0
67 mol 25 unq 20 iso 0 dist 7.17969 7.92503 5.30154 6.08585 7.55264 11.4912 10.6808 12.9968 8.6653 16.3984 11.037 14.9982 17.5013 9.16515 20.904 numMergedOcc 0
68 mol 25 unq 21 iso 0 dist 7.17969 7.92503 5.30154 6.08585 7.55264 11.4912 10.6808 12.9968 8.6653 16.3984 13.0315 14.1251 17.4121 9.82987 22.9087 numMergedOcc 0
69 mol 25 unq 22 iso 0 dist 7.17969 7.92503 5.30154 6.08585 7.55264 11.4912 10.6808 12.9968 8.6653 16.3984 11.971 8.41421 12.1404 9.40732 19.9467 numMergedOcc 0
70 mol 25 unq 23 iso 0 dist 7.17969 7.92503 5.30154 6.08585 7.55264 11.4912 10.6808 12.9968 8.6653 16.3984 9.48085 5.68041 10.2758 6.53269 17.8732 numMergedOcc 0
71 mol 25 unq 24 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 16.1048 11.9561 8.87757 7.33728 10.3338 5.63212 3.904 5.20109 7.05196 numMergedOcc 0
72 mol 25 unq 25 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 4.33106 7.57578 8.50222 9.34396 10.3338 5.63212 3.904 5.20109 10.9703 numMergedOcc 0
73 mol 25 unq 26 iso 0 dist 6.03987 8.6653 5.82503 5.68392 6.85556 12.0452 10.6808 11.6743 7.92503 15.1839 7.6114 5.86705 10.8122 6.29797 16.617 numMergedOcc 0
74 mol 58 unq 0 iso 0 dist 6.86465 9.92355 5.78774 10.2049 8.80614 10.2007 5.30792 6.62496 5.93884 9.95364 15.888 11.3019 10.3684 7.58739 13.813 numMergedOcc 0
75 mol 58 unq 1 iso 0 dist 6.86465 9.92355 5.78774 10.2049 8.80614 10.2007 5.30792 6.62496 5.93884 9.95364 13.3281 9.87158 5.66912 9.01564 9.22598 numMergedOcc 0
76 mol 58 unq 2 iso 0 dist 6.86465 9.92355 5.78774 10.2049 8.80614 10.2007 5.30792 6.62496 5.93884 9.95364 11.5155 5.86526 5.76523 7.11065 9.55996 numMergedOcc 0
77 mol 58 unq 3 iso 0 dist 6.86465 9.92355 5.78774 10.2049 8.80614 10.2007 5.35073 6.35756 7.68678 5.49591 15.888 11.3019 10.3684 7.58739 11.2189 numMergedOcc 0
78 mol 58 unq 4 iso 0 dist 6.86465 9.92355 5.78774 10.2049 8.80614 10.2007 5.35073 6.35756 7.68678 5.49591 13.3281 9.87158 5.66912 9.01564 8.96727 numMergedOcc 0
79 mol 58 unq 5 iso 0 dist 6.86465 9.92355 5.78774 10.2049 8.80614 10.2007 5.35073 6.35756 7.68678 5.49591 11.5155 5.86526 5.76523 7.11065 8.01308 numMergedOcc 0
80 mol 58 unq 6 iso 0 dist 6.62496 5.93884 5.78774 9.95364 8.80614 10.2007 5.30792 6.86465 9.92355 10.2049 13.813 11.3019 10.3684 7.58739 15.888 numMergedOcc 0
81 mol 58 unq 7 iso 0 dist 6.62496 5.93884 5.78774 9.95364 8.80614 10.2007 5.30792 6.86465 9.92355 10.2049 9.22598 9.87158 5.66912 9.01564 13.3281 numMergedOcc 0
82 mol 58 unq 8 iso 0 dist 6.62496 5.93884 5.78774 9.95364 8.80614 10.2007 5.30792 6.86465 9.92355 10.2049 9.55996 5.86526 5.76523 7.11065 11.5155 numMergedOcc 0
83 mol 58 unq 9 iso 0 dist 6.62496 5.93884 5.78774 9.95364 8.80614 10.2007 4.81926 6.35756 7.68678 5.49591 13.813 11.3019 10.3684 7.58739 11.2189 numMergedOcc 0
84 mol 58 unq 10 iso 0 dist 6.62496 5.93884 5.78774 9.95364 8.80614 10.2007 4.81926 6.35756 7.68678 5.49591 9.22598 9.87158 5.66912 9.01564 8.96727 numMergedOcc 0
85 mol 58 unq 11 iso 0 dist 6.62496 5.93884 5.78774 9.95364 8.80614 10.2007 4.81926 6.35756 7.68678 5.49591 9.55996 5.86526 5.76523 7.11065 8.01308 numMergedOcc 0
86 mol 58 unq 12 iso 0 dist 6.35756 7.68678 5.78774 5.49591 8.80614 10.2007 5.35073 6.86465 9.92355 10.2049 11.2189 11.3019 10.3684 7.58739 15.888 numMergedOcc 0
87 mol 58 unq 13 iso 0 dist 6.35756 7.68678 5.78774 5.49591 8.80614 10.2007 5.35073 6.86465 9.92355 10.2049 8.96727 9.87158 5.66912 9.01564 13.3281 numMergedOcc 0
88 mol 58 unq 14 iso 0 dist 6.35756 7.68678 5.78774 5.49591 8.80614 10.2007 5.35073 6.86465 9.92355 10.2049 8.01308 5.86526 5.76523 7.11065 11.5155 numMergedOcc 0
89 mol 58 unq 15 iso 0 dist 6.35756 7.68678 5.78774 5.49591 8.80614 10.2007 4.81926 6.62496 5.93884 9.95364 11.2189 11.3019 10.3684 7.58739 13.813 numMergedOcc 0
90 mol 58 unq 16 iso 0 dist 6.35756 7.68678 5.78774 5.49591 8.80614 10.2007 4.81926 6.62496 5.93884 9.95364 8.96727 9.87158 5.66912 9.01564 9.22598 numMergedOcc 0
91 mol 58 unq 17 iso 0 dist 6.35756 7.68678 5.78774 5.49591 8.80614 10.2007 4.81926 6.62496 5.93884 9.95364 8.01308 5.86526 5.76523 7.11065 9.55996 numMergedOcc 0
92 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 4.4057 6.65501 6.88901 8.40073 6.10456 4.47349 9.67482 9.81956 10.4782 3.92737 8.46823 7.54889 numMergedOcc 0
93 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 4.4057 6.65501 6.88901 8.40073 6.10456 4.47349 9.67482 5.10496 3.9764 3.94967 4.62494 5.2571 numMergedOcc 0
94 mol 98 unq 2 iso 0 dist 5.08437 6.7117 7.06961 4.4057 6.65501 6.88901 10.2427 10.1136 5.65185 12.0974 9.81956 10.4782 3.92737 8.46823 7.78931 numMergedOcc 0
95 mol 98 unq 3 iso 0 dist 5.08437 6.7117 7.06961 4.4057 6.65501 6.88901 10.2427 10.1136 5.65185 12.0974 5.10496 3.9764 3.94967 4.62494 8.7497 numMergedOcc 0
96 mol 98 unq 4 iso 0 dist 6.10456 4.47349 7.06961 9.67482 6.65501 6.88901 8.40073 5.08437 6.7117 4.4057 7.54889 10.4782 3.92737 8.46823 9.81956 numMergedOcc 0
97 mol 98 unq 5 iso 0 dist 6.10456 4.47349 7.06961 9.67482 6.65501 6.88901 8.40073 5.08437 6.7117 4.4057 5.2571 3.9764 3.94967 4.62494 5.10496 numMergedOcc 0
98 mol 98 unq 6 iso 0 dist 6.10456 4.47349 7.06961 9.67482 6.65501 6.88901 5.02887 10.1136 5.65185 12.0974 7.54889 10.4782 3.92737 8.46823 7.78931 numMergedOcc 0
99 mol 98 unq 7 iso 0 dist 6.10456 4.47349 7.06961 9.67482 6.65501 6.88901 5.02887 10.1136 5.65185 12.0974 5.2571 3.9764 3.94967 4.62494 8.7497 numMergedOcc 0
100 mol 100 unq 0 iso 0 dist 7.17106 7.10378 10.6848 8.4128 7.01812 9.5057 10.8586 10.1489 7.80975 5.42531 10.5432 4.03277 12.48 6.59691 9.21662 numMergedOcc 0
101 mol 134 unq 0 iso 0 dist 9.89303 5.83771 7.41674 4.60632 7.69991 6.40575 5.79898 6.54501 7.80532 5.71679 13.0242 12.847 15.0575 9.0176 11.988 numMergedOcc 0
102 mol 134 unq 1 iso 0 dist 6.54501 7.80532 7.41674 5.71679 7.69991 6.40575 5.79898 9.89303 5.83771 4.60632 11.988 12.847 15.0575 9.0176 13.0242 numMergedOcc 0
103 mol 134 unq 2 iso 0 dist 6.49416 7.80532 9.87376 5.71679 6.23142 6.40575 5.79898 9.93925 5.83771 4.60632 11.988 8.06642 15.0575 9.0176 13.0242 numMergedOcc 0
104 mol 181 unq 0 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 6.01247 10.9639 6.22122 6.06566 10.0802 6.28125 5.3698 9.06571 10.0333 numMergedOcc 0
105 mol 181 unq 1 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 6.01247 10.9639 6.22122 6.06566 9.76212 6.50233 6.39406 7.35884 8.59874 numMergedOcc 0
106 mol 181 unq 2 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 8.88798 10.7062 7.99195 12.2164 10.0802 6.28125 5.3698 9.06571 10.9279 numMergedOcc 0
107 mol 181 unq 3 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 8.88798 10.7062 7.99195 12.2164 9.76212 6.50233 6.39406 7.35884 13.2783 numMergedOcc 0
108 mol 181 unq 4 iso 0 dist 8.03334 6.2479 7.81713 8.04639 6.59025 8.86197 6.01247 10.9639 6.22122 13.0409 10.0802 6.28125 5.3698 9.88897 10.0333 numMergedOcc 0
109 mol 181 unq 5 iso 0 dist 8.03334 6.2479 7.81713 8.04639 6.59025 8.86197 8.88798 10.7062 7.99195 5.77299 10.0802 6.28125 5.3698 9.88897 10.9279 numMergedOcc 0
110 mol 181 unq 6 iso 0 dist 7.81386 9.39829 7.20191 7.77758 5.94469 11.8933 8.85576 7.63312 6.41453 12.5387 9.81178 5.42158 6.16988 8.06308 10.6106 numMergedOcc 0
111 mol 181 unq 7 iso 0 dist 7.63312 6.41453 7.20191 12.5387 5.94469 11.8933 8.85576 7.81386 9.39829 7.77758 10.6106 5.42158 6.16988 8.06308 9.81178 numMergedOcc 0
112 mol 231 unq 0 iso 0 dist 7.37839 6.98875 6.37275 9.0443 7.79066 12.7246 4.06055 8.40182 6.54852 12.1512 9.97669 4.15084 6.94651 9.60504 11.4076 numMergedOcc 0
113 mol 231 unq 1 iso 0 dist 8.40182 6.54852 6.37275 12.1512 7.79066 12.7246 4.06055 7.37839 6.98875 9.0443 11.4076 4.15084 6.94651 9.60504 9.97669 numMergedOcc 0
114 mol 232 unq 0 iso 0 dist 8.27212 9.40808 4.9377 8.80479 9.05071 9.8664 6.56633 10.5803 8.50102 12.3508 10.3021 5.42461 4.68548 6.59036 11.4909 numMergedOcc 0
