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1 mol 7 unq 0 iso 1 dist 6.02702 6.55304 6.14469 9.60499 8.43473 6.7985 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 6.7985 8.43473 6.14469 11.0773 6.34041 8.72114 numMergedOcc 0
3 mol 7 unq 1 iso 1 dist 8.72114 6.34041 6.14469 11.0773 8.43473 6.7985 numMergedOcc 0
4 mol 7 unq 2 iso 0 dist 9.68596 5.03847 6.14469 10.6581 6.55304 6.02702 numMergedOcc 0
5 mol 7 unq 2 iso 1 dist 6.02702 6.55304 6.14469 10.6581 5.03847 9.68596 numMergedOcc 0
6 mol 7 unq 3 iso 0 dist 9.68596 5.03847 6.14469 10.5461 6.34041 8.72114 numMergedOcc 0
7 mol 7 unq 3 iso 1 dist 8.72114 6.34041 6.14469 10.5461 5.03847 9.68596 numMergedOcc 0
8 mol 9 unq 0 iso 0 dist 9.62394 16.147 7.35972 15.1483 8.50424 7.32257 numMergedOcc 0
9 mol 9 unq 0 iso 1 dist 7.32257 8.50424 7.35972 15.1483 16.147 9.62394 numMergedOcc 0
10 mol 9 unq 1 iso 0 dist 9.62394 16.147 7.35972 14.896 6.02809 6.55811 numMergedOcc 0
11 mol 9 unq 1 iso 1 dist 6.55811 6.02809 7.35972 14.896 16.147 9.62394 numMergedOcc 0
12 mol 9 unq 2 iso 0 dist 9.62394 16.147 7.35972 13.3648 4.98827 8.64915 numMergedOcc 0
13 mol 9 unq 2 iso 1 dist 8.64915 4.98827 7.35972 13.3648 16.147 9.62394 numMergedOcc 0
14 mol 9 unq 3 iso 0 dist 9.62394 19.4709 9.93542 14.896 6.02809 7.36018 numMergedOcc 0
15 mol 9 unq 3 iso 1 dist 7.36018 6.02809 9.93542 14.896 19.4709 9.62394 numMergedOcc 0
16 mol 9 unq 4 iso 0 dist 9.62394 19.4709 9.93542 13.3648 4.98827 8.17347 numMergedOcc 0
17 mol 9 unq 4 iso 1 dist 8.17347 4.98827 9.93542 13.3648 19.4709 9.62394 numMergedOcc 0
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19 mol 11 unq 0 iso 1 dist 6.35398 10.9183 7.98326 14.7815 10.7734 5.96346 numMergedOcc 0
20 mol 15 unq 0 iso 0 dist 5.89412 9.75966 6.03257 11.3543 10.1154 6.42748 numMergedOcc 0
21 mol 15 unq 0 iso 1 dist 6.42748 10.1154 6.03257 11.3543 9.75966 5.89412 numMergedOcc 0
22 mol 15 unq 1 iso 0 dist 5.89412 9.75966 6.03257 9.88835 4.29582 7.48342 numMergedOcc 0
23 mol 15 unq 1 iso 1 dist 7.48342 4.29582 6.03257 9.88835 9.75966 5.89412 numMergedOcc 0
24 mol 15 unq 1 iso 0 dist 6.42748 10.1154 6.03257 10.6338 4.39605 7.07399 numMergedOcc 0
25 mol 15 unq 1 iso 1 dist 7.07399 4.39605 6.03257 10.6338 10.1154 6.42748 numMergedOcc 0
26 mol 15 unq 2 iso 0 dist 7.48342 4.29582 6.03257 8.38064 4.39605 7.07399 numMergedOcc 0
27 mol 15 unq 2 iso 1 dist 7.07399 4.39605 6.03257 8.38064 4.29582 7.48342 numMergedOcc 0
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29 mol 19 unq 0 iso 1 dist 6.41575 9.74255 9.95212 8.4674 4.64838 8.40416 numMergedOcc 0
30 mol 19 unq 1 iso 0 dist 8.40416 4.64838 9.95212 4.51865 7.08342 6.41423 numMergedOcc 0
31 mol 19 unq 1 iso 1 dist 6.41423 7.08342 9.95212 4.51865 4.64838 8.40416 numMergedOcc 0
32 mol 19 unq 2 iso 0 dist 7.75618 4.97119 9.95212 4.54938 9.74255 6.41575 numMergedOcc 0
33 mol 19 unq 2 iso 1 dist 6.41575 9.74255 9.95212 4.54938 4.97119 7.75618 numMergedOcc 0
34 mol 19 unq 3 iso 0 dist 7.75618 4.97119 9.95212 6.864 7.08342 6.41423 numMergedOcc 0
35 mol 19 unq 3 iso 1 dist 6.41423 7.08342 9.95212 6.864 4.97119 7.75618 numMergedOcc 0
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37 mol 24 unq 0 iso 1 dist 9.41441 4.32034 8.00171 6.86014 6.66749 7.33768 numMergedOcc 0
38 mol 24 unq 1 iso 0 dist 7.33768 6.66749 8.00171 11.0194 11.9112 6.73939 numMergedOcc 0
39 mol 24 unq 1 iso 1 dist 6.73939 11.9112 8.00171 11.0194 6.66749 7.33768 numMergedOcc 0
40 mol 24 unq 1 iso 0 dist 9.41441 8.67951 4.2121 6.86014 6.66749 9.01567 numMergedOcc 0
41 mol 24 unq 1 iso 1 dist 9.01567 6.66749 4.2121 6.86014 8.67951 9.41441 numMergedOcc 0
42 mol 24 unq 2 iso 0 dist 9.41441 8.52463 6.72323 15.5324 12.176 8.4051 numMergedOcc 0
43 mol 24 unq 2 iso 1 dist 8.4051 12.176 6.72323 15.5324 8.52463 9.41441 numMergedOcc 0
44 mol 24 unq 3 iso 0 dist 9.41441 8.52463 6.72323 6.86014 6.66749 7.29868 numMergedOcc 0
45 mol 24 unq 3 iso 1 dist 7.29868 6.66749 6.72323 6.86014 8.52463 9.41441 numMergedOcc 0
46 mol 24 unq 4 iso 0 dist 9.41441 8.52463 6.72323 8.86116 14.012 8.60554 numMergedOcc 0
47 mol 24 unq 4 iso 1 dist 8.60554 14.012 6.72323 8.86116 8.52463 9.41441 numMergedOcc 0
48 mol 24 unq 2 iso 0 dist 9.01567 6.66749 4.2121 11.0194 4.50066 6.73939 numMergedOcc 0
49 mol 24 unq 2 iso 1 dist 6.73939 4.50066 4.2121 11.0194 6.66749 9.01567 numMergedOcc 0
50 mol 24 unq 2 iso 0 dist 6.73939 5.11617 6.72323 5.54419 12.176 8.4051 numMergedOcc 0
51 mol 24 unq 2 iso 1 dist 8.4051 12.176 6.72323 5.54419 5.11617 6.73939 numMergedOcc 0
52 mol 24 unq 3 iso 0 dist 6.73939 5.11617 6.72323 11.0194 6.66749 7.29868 numMergedOcc 0
53 mol 24 unq 3 iso 1 dist 7.29868 6.66749 6.72323 11.0194 5.11617 6.73939 numMergedOcc 0
54 mol 24 unq 4 iso 0 dist 6.73939 5.11617 6.72323 13.2433 14.012 8.60554 numMergedOcc 0
55 mol 24 unq 4 iso 1 dist 8.60554 14.012 6.72323 13.2433 5.11617 6.73939 numMergedOcc 0
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57 mol 25 unq 0 iso 1 dist 6.16347 6.08585 6.25843 11.9561 7.33728 8.87757 numMergedOcc 0
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59 mol 25 unq 1 iso 1 dist 7.45383 5.77929 6.25843 5.04899 7.33728 8.87757 numMergedOcc 0
60 mol 25 unq 2 iso 0 dist 8.87757 13.9331 8.88938 5.04899 5.77929 9.01548 numMergedOcc 0
61 mol 25 unq 2 iso 1 dist 9.01548 5.77929 8.88938 5.04899 13.9331 8.87757 numMergedOcc 0
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63 mol 25 unq 1 iso 1 dist 8.50222 9.34396 6.25843 7.57578 6.08585 6.16347 numMergedOcc 0
64 mol 25 unq 2 iso 0 dist 6.16347 6.08585 6.25843 7.17969 10.8498 7.55264 numMergedOcc 0
65 mol 25 unq 2 iso 1 dist 7.55264 10.8498 6.25843 7.17969 6.08585 6.16347 numMergedOcc 0
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67 mol 25 unq 2 iso 1 dist 8.50222 9.34396 6.25843 12.7009 5.77929 7.45383 numMergedOcc 0
68 mol 25 unq 3 iso 0 dist 7.45383 5.77929 6.25843 12.8117 10.8498 7.55264 numMergedOcc 0
69 mol 25 unq 3 iso 1 dist 7.55264 10.8498 6.25843 12.8117 5.77929 7.45383 numMergedOcc 0
70 mol 25 unq 3 iso 0 dist 9.01548 5.77929 8.88938 12.7009 10.5328 8.50222 numMergedOcc 0
71 mol 25 unq 3 iso 1 dist 8.50222 10.5328 8.88938 12.7009 5.77929 9.01548 numMergedOcc 0
72 mol 25 unq 4 iso 0 dist 9.01548 5.77929 8.88938 12.8117 10.4337 7.55264 numMergedOcc 0
73 mol 25 unq 4 iso 1 dist 7.55264 10.4337 8.88938 12.8117 5.77929 9.01548 numMergedOcc 0
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167 mol 274 unq 1 iso 1 dist 9.85289 5.29529 6.88827 11.3168 6.16703 6.39866 numMergedOcc 0
