0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 6.55304 6.7985 6.14469 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.60499 6.7985 6.55304 8.43473 6.02702 6.14469 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.41585 9.68596 14.7759 5.03847 10.3148 6.14469 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.10621 8.72114 13.8829 6.34041 12.9581 6.14469 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 8.57077 9.62394 9.5997 16.147 14.519 7.35972 numMergedOcc 0
5 mol 9 unq 1 iso 0 dist 8.57077 9.62394 9.5997 19.4709 18.1148 9.93542 numMergedOcc 0
6 mol 11 unq 0 iso 0 dist 4.61088 5.96346 6.86684 10.7734 13.8584 7.98326 numMergedOcc 0
7 mol 11 unq 1 iso 0 dist 4.61088 5.96346 6.86684 9.62262 10.604 7.46578 numMergedOcc 0
8 mol 15 unq 0 iso 0 dist 8.38064 7.48342 4.39605 4.29582 7.07399 6.03257 numMergedOcc 0
9 mol 15 unq 1 iso 0 dist 8.38064 7.07399 4.29582 4.39605 7.48342 6.03257 numMergedOcc 0
10 mol 15 unq 2 iso 0 dist 9.97507 7.48342 12.1303 4.29582 11.7302 6.03257 numMergedOcc 0
11 mol 19 unq 0 iso 0 dist 7.20519 7.75618 4.96411 4.97119 10.741 9.95212 numMergedOcc 0
12 mol 19 unq 1 iso 0 dist 8.4674 8.40416 9.74255 4.64838 6.41575 9.95212 numMergedOcc 0
13 mol 19 unq 2 iso 0 dist 8.4674 6.41575 4.64838 9.74255 8.40416 9.95212 numMergedOcc 0
14 mol 19 unq 3 iso 0 dist 4.54938 7.75618 9.74255 4.97119 6.41575 9.95212 numMergedOcc 0
15 mol 19 unq 4 iso 0 dist 4.54938 6.41575 4.97119 9.74255 7.75618 9.95212 numMergedOcc 0
16 mol 19 unq 5 iso 0 dist 7.82074 6.41575 6.01808 9.74255 12.3215 9.95212 numMergedOcc 0
17 mol 19 unq 6 iso 0 dist 4.51865 8.40416 7.08342 4.64838 6.41423 9.95212 numMergedOcc 0
18 mol 19 unq 7 iso 0 dist 4.51865 6.41423 4.64838 7.08342 8.40416 9.95212 numMergedOcc 0
19 mol 19 unq 8 iso 0 dist 6.864 7.75618 7.08342 4.97119 6.41423 9.95212 numMergedOcc 0
20 mol 19 unq 9 iso 0 dist 6.864 6.41423 4.97119 7.08342 7.75618 9.95212 numMergedOcc 0
21 mol 24 unq 0 iso 0 dist 6.86014 7.33768 4.32034 6.66749 9.41441 8.00171 numMergedOcc 0
22 mol 24 unq 1 iso 0 dist 6.86014 9.01567 8.67951 6.66749 9.41441 4.2121 numMergedOcc 0
23 mol 24 unq 2 iso 0 dist 6.86014 7.29868 8.52463 6.66749 9.41441 6.72323 numMergedOcc 0
24 mol 24 unq 3 iso 0 dist 6.86014 9.41441 6.66749 4.32034 7.33768 8.00171 numMergedOcc 0
25 mol 24 unq 4 iso 0 dist 6.86014 9.41441 6.66749 12.2662 12.2059 5.95834 numMergedOcc 0
26 mol 24 unq 5 iso 0 dist 6.86014 9.41441 6.66749 8.67951 9.01567 4.2121 numMergedOcc 0
27 mol 24 unq 6 iso 0 dist 6.86014 9.41441 6.66749 8.52463 7.29868 6.72323 numMergedOcc 0
28 mol 24 unq 7 iso 0 dist 8.86116 8.60554 8.52463 14.012 9.41441 6.72323 numMergedOcc 0
29 mol 24 unq 8 iso 0 dist 8.86116 9.41441 14.012 4.32034 12.9284 8.00171 numMergedOcc 0
30 mol 24 unq 9 iso 0 dist 8.86116 9.41441 14.012 12.2662 17.592 5.95834 numMergedOcc 0
31 mol 24 unq 10 iso 0 dist 8.86116 9.41441 14.012 8.67951 13.4393 4.2121 numMergedOcc 0
32 mol 24 unq 11 iso 0 dist 8.86116 9.41441 14.012 8.52463 8.60554 6.72323 numMergedOcc 0
33 mol 24 unq 12 iso 0 dist 8.38394 8.60554 12.3994 14.012 15.392 6.72323 numMergedOcc 0
34 mol 24 unq 13 iso 0 dist 5.54419 8.4051 5.11617 12.176 6.73939 6.72323 numMergedOcc 0
35 mol 24 unq 14 iso 0 dist 5.54419 6.73939 12.176 6.56748 11.3566 5.95834 numMergedOcc 0
36 mol 24 unq 15 iso 0 dist 5.54419 6.73939 12.176 4.50066 9.83002 4.2121 numMergedOcc 0
37 mol 24 unq 16 iso 0 dist 5.54419 6.73939 12.176 11.9112 16.8439 8.00171 numMergedOcc 0
38 mol 24 unq 17 iso 0 dist 5.54419 6.73939 12.176 5.11617 8.4051 6.72323 numMergedOcc 0
39 mol 24 unq 18 iso 0 dist 7.36323 8.4051 13.2229 12.176 18.673 6.72323 numMergedOcc 0
40 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 5.77929 8.87757 6.25843 numMergedOcc 0
41 mol 25 unq 1 iso 0 dist 5.04899 9.01548 13.9331 5.77929 8.87757 8.88938 numMergedOcc 0
42 mol 25 unq 2 iso 0 dist 5.04899 8.87757 5.77929 7.33728 7.45383 6.25843 numMergedOcc 0
43 mol 25 unq 3 iso 0 dist 5.04899 8.87757 5.77929 13.9331 9.01548 8.88938 numMergedOcc 0
44 mol 25 unq 4 iso 0 dist 7.57578 6.16347 9.34396 6.08585 8.50222 6.25843 numMergedOcc 0
45 mol 25 unq 5 iso 0 dist 7.57578 8.50222 6.08585 9.34396 6.16347 6.25843 numMergedOcc 0
46 mol 25 unq 6 iso 0 dist 7.57578 8.50222 6.08585 10.5328 13.8469 8.88938 numMergedOcc 0
47 mol 25 unq 7 iso 0 dist 7.17969 6.16347 10.8498 6.08585 7.55264 6.25843 numMergedOcc 0
48 mol 25 unq 8 iso 0 dist 7.17969 7.55264 6.08585 10.8498 6.16347 6.25843 numMergedOcc 0
49 mol 25 unq 9 iso 0 dist 7.17969 7.55264 6.08585 10.4337 13.8469 8.88938 numMergedOcc 0
50 mol 54 unq 0 iso 0 dist 6.83299 6.14538 4.29856 4.24786 10.4031 9.17082 numMergedOcc 0
51 mol 60 unq 0 iso 0 dist 8.7531 9.90939 7.04075 5.94827 11.816 8.97364 numMergedOcc 0
52 mol 73 unq 0 iso 0 dist 9.96396 9.24757 5.11416 6.29906 12.1382 8.87464 numMergedOcc 0
53 mol 73 unq 1 iso 0 dist 6.19304 9.24757 6.56633 6.29906 10.2755 8.87464 numMergedOcc 0
54 mol 73 unq 2 iso 0 dist 8.70481 9.24757 15.3808 6.29906 10.8139 8.87464 numMergedOcc 0
55 mol 85 unq 0 iso 0 dist 7.97049 9.82915 9.29301 10.4987 14.4725 9.66222 numMergedOcc 0
56 mol 85 unq 1 iso 0 dist 7.47541 9.82915 13.5116 10.4987 17.5738 9.66222 numMergedOcc 0
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58 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 7.94178 11.3043 7.36769 numMergedOcc 0
59 mol 98 unq 2 iso 0 dist 5.08437 6.7117 7.06961 4.4057 6.65501 6.88901 numMergedOcc 0
60 mol 98 unq 3 iso 0 dist 6.48948 6.65501 7.42446 7.06961 9.42961 6.88901 numMergedOcc 0
61 mol 98 unq 4 iso 0 dist 6.10456 6.65501 9.67482 7.06961 4.47349 6.88901 numMergedOcc 0
62 mol 98 unq 5 iso 0 dist 6.10456 4.47349 7.06961 9.85543 11.3043 7.36769 numMergedOcc 0
63 mol 98 unq 6 iso 0 dist 6.10456 4.47349 7.06961 9.67482 6.65501 6.88901 numMergedOcc 0
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65 mol 100 unq 1 iso 0 dist 8.87449 7.80975 7.97897 4.86592 10.8527 5.75014 numMergedOcc 0
66 mol 100 unq 2 iso 0 dist 9.60661 7.01812 5.80144 10.6848 14.8081 9.5057 numMergedOcc 0
67 mol 100 unq 3 iso 0 dist 7.17106 7.10378 10.6848 8.4128 7.01812 9.5057 numMergedOcc 0
68 mol 100 unq 4 iso 0 dist 7.17106 7.10378 10.6848 7.96533 10.4538 5.75014 numMergedOcc 0
69 mol 100 unq 5 iso 0 dist 7.17106 7.01812 8.4128 10.6848 7.10378 9.5057 numMergedOcc 0
70 mol 100 unq 6 iso 0 dist 9.35224 7.01812 10.0456 10.6848 15.2289 9.5057 numMergedOcc 0
71 mol 100 unq 7 iso 0 dist 7.47343 8.30845 12.2861 15.3454 21.075 9.5057 numMergedOcc 0
72 mol 100 unq 8 iso 0 dist 6.65086 8.30845 5.80144 15.3454 14.8081 9.5057 numMergedOcc 0
73 mol 100 unq 9 iso 0 dist 6.56369 8.30845 10.0456 15.3454 15.2289 9.5057 numMergedOcc 0
74 mol 100 unq 10 iso 0 dist 9.30209 8.30845 6.70236 15.3454 12.6004 9.5057 numMergedOcc 0
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92 mol 134 unq 5 iso 0 dist 6.37586 6.23142 5.29786 9.87376 10.7586 6.40575 numMergedOcc 0
93 mol 134 unq 6 iso 0 dist 6.49416 7.80532 9.87376 5.71679 6.23142 6.40575 numMergedOcc 0
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100 mol 156 unq 3 iso 0 dist 8.34702 8.61587 12.4274 5.52796 12.7005 6.86566 numMergedOcc 0
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102 mol 156 unq 5 iso 0 dist 7.44554 9.44367 5.4555 5.71511 9.4013 8.37434 numMergedOcc 0
103 mol 156 unq 6 iso 0 dist 7.66148 7.90267 6.03934 6.13574 11.1147 8.37434 numMergedOcc 0
104 mol 156 unq 7 iso 0 dist 8.94056 9.4013 6.13574 5.4555 7.90267 8.37434 numMergedOcc 0
105 mol 156 unq 8 iso 0 dist 8.94056 7.90267 5.4555 6.13574 9.4013 8.37434 numMergedOcc 0
106 mol 156 unq 9 iso 0 dist 9.83699 9.4013 5.80008 5.4555 10.3379 8.37434 numMergedOcc 0
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108 mol 156 unq 11 iso 0 dist 9.06726 7.30357 12.3086 5.52796 13.258 5.41575 numMergedOcc 0
109 mol 156 unq 12 iso 0 dist 9.06726 8.61587 10.9151 5.81563 11.5017 5.9976 numMergedOcc 0
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118 mol 181 unq 3 iso 0 dist 8.03334 6.59025 8.04639 7.81713 6.2479 8.86197 numMergedOcc 0
119 mol 181 unq 4 iso 0 dist 8.03334 6.59025 8.04639 7.16549 12.8648 5.94379 numMergedOcc 0
120 mol 181 unq 5 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 numMergedOcc 0
121 mol 181 unq 6 iso 0 dist 8.03334 6.2479 7.81713 8.04639 6.59025 8.86197 numMergedOcc 0
122 mol 181 unq 7 iso 0 dist 5.98885 9.72611 5.6044 12.7358 11.602 7.22883 numMergedOcc 0
123 mol 181 unq 8 iso 0 dist 5.98885 7.99195 6.6251 12.2164 12.4878 7.32087 numMergedOcc 0
124 mol 181 unq 9 iso 0 dist 5.98885 7.99195 6.6251 5.77299 10.6908 8.86197 numMergedOcc 0
125 mol 181 unq 10 iso 0 dist 9.09537 9.72611 12.9468 12.7358 14.8662 7.22883 numMergedOcc 0
126 mol 181 unq 11 iso 0 dist 9.09537 7.99195 10.09 12.2164 16.4314 7.32087 numMergedOcc 0
127 mol 181 unq 12 iso 0 dist 9.09537 7.99195 10.09 5.77299 11.3325 8.86197 numMergedOcc 0
128 mol 181 unq 13 iso 0 dist 7.81386 5.94469 7.77758 9.69409 14.08 9.92471 numMergedOcc 0
129 mol 181 unq 14 iso 0 dist 7.63312 5.9176 5.63555 6.29863 11.9764 7.22883 numMergedOcc 0
130 mol 181 unq 15 iso 0 dist 7.63312 5.94469 12.5387 9.69409 15.9489 9.92471 numMergedOcc 0
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132 mol 192 unq 1 iso 0 dist 5.59424 8.77999 8.49529 14.8459 12.708 9.36796 numMergedOcc 0
133 mol 192 unq 2 iso 0 dist 7.00794 8.77999 11.7523 12.717 16.9245 6.60053 numMergedOcc 0
134 mol 192 unq 3 iso 0 dist 7.00794 8.77999 11.7523 14.8459 18.1003 9.36796 numMergedOcc 0
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137 mol 232 unq 2 iso 0 dist 8.27212 9.40808 4.9377 8.80479 9.05071 9.8664 numMergedOcc 0
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139 mol 249 unq 1 iso 0 dist 6.18582 5.48118 7.04666 9.0676 12.4721 5.9627 numMergedOcc 0
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143 mol 274 unq 2 iso 0 dist 7.56915 9.85289 6.20558 5.29529 8.52587 6.88827 numMergedOcc 0
144 mol 274 unq 3 iso 0 dist 8.49997 9.85289 11.4459 5.29529 11.6126 6.88827 numMergedOcc 0
