0 mol 8 unq 0 iso 0 dist 4.92734 7.35767 8.96553 7.0822 8.33604 8.27181 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.70735 9.40358 9.97507 9.5538 7.12903 5.90976 numMergedOcc 0
2 mol 15 unq 1 iso 0 dist 9.70735 4.90888 6.82505 9.5538 7.12903 5.51916 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 6.84569 5.46269 5.46498 5.66529 6.58035 5.94084 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 6.84569 5.46269 5.46498 6.32814 8.41862 6.73355 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 6.23095 10.747 7.31767 7.40735 7.685 8.43188 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 6.23095 11.5983 6.03987 7.40735 7.685 10.3635 numMergedOcc 0
7 mol 26 unq 0 iso 0 dist 7.51406 6.4487 8.34347 9.20028 9.16962 11.887 numMergedOcc 0
8 mol 52 unq 0 iso 0 dist 5.26018 12.8491 9.80098 9.26324 7.18176 5.93337 numMergedOcc 0
9 mol 52 unq 1 iso 0 dist 5.26018 10.3287 7.34143 9.26324 7.18176 4.5482 numMergedOcc 0
10 mol 52 unq 2 iso 0 dist 7.1203 5.92851 9.80098 6.22409 7.18176 5.93337 numMergedOcc 0
11 mol 52 unq 3 iso 0 dist 7.1203 6.03647 7.34143 6.22409 7.18176 4.5482 numMergedOcc 0
12 mol 61 unq 0 iso 0 dist 9.70415 5.46309 6.65721 10.4362 8.76003 5.83489 numMergedOcc 0
13 mol 61 unq 1 iso 0 dist 9.70415 11.9897 6.72123 10.4362 8.76003 7.39396 numMergedOcc 0
14 mol 70 unq 0 iso 0 dist 7.63663 14.2824 9.65964 14.4842 7.92394 6.65811 numMergedOcc 0
15 mol 70 unq 1 iso 0 dist 7.63663 14.2824 9.65964 14.7467 9.93423 5.47516 numMergedOcc 0
16 mol 70 unq 2 iso 0 dist 7.63663 14.2824 9.65964 5.93792 9.34122 11.0952 numMergedOcc 0
17 mol 72 unq 0 iso 0 dist 6.68311 8.1124 8.8178 13.1473 6.77912 12.0644 numMergedOcc 0
18 mol 72 unq 1 iso 0 dist 6.68311 15.0607 9.96708 13.1473 6.77912 7.11552 numMergedOcc 0
19 mol 72 unq 2 iso 0 dist 6.7212 11.6369 9.96708 5.00053 7.321 9.0131 numMergedOcc 0
20 mol 72 unq 3 iso 0 dist 6.7212 6.12361 9.78528 5.00053 7.321 6.11922 numMergedOcc 0
21 mol 73 unq 0 iso 0 dist 6.10011 8.3449 5.93252 10.0721 5.64598 9.77992 numMergedOcc 0
22 mol 73 unq 1 iso 0 dist 8.124 13.4367 6.19304 10.0721 4.65521 7.41074 numMergedOcc 0
23 mol 85 unq 0 iso 0 dist 6.56728 11.609 7.47541 8.46482 7.22293 7.98917 numMergedOcc 0
24 mol 85 unq 1 iso 0 dist 6.56728 13.5384 7.66905 8.46482 7.22293 11.6116 numMergedOcc 0
25 mol 85 unq 2 iso 0 dist 6.56728 5.29763 5.73196 8.46482 7.22293 6.47779 numMergedOcc 0
26 mol 86 unq 0 iso 0 dist 8.40609 9.54732 9.5497 6.82648 7.79359 9.68893 numMergedOcc 0
27 mol 100 unq 0 iso 0 dist 8.92577 6.89293 6.45675 7.38658 8.72704 7.2495 numMergedOcc 0
28 mol 100 unq 1 iso 0 dist 8.92577 12.0555 7.47343 7.38658 8.72704 10.1589 numMergedOcc 0
29 mol 100 unq 2 iso 0 dist 8.92577 12.7188 8.86688 7.38658 8.72704 15.9331 numMergedOcc 0
30 mol 100 unq 3 iso 0 dist 9.56324 15.1093 6.45675 15.7025 8.72704 7.2495 numMergedOcc 0
31 mol 100 unq 4 iso 0 dist 9.56324 16.8752 7.47343 15.7025 8.72704 10.1589 numMergedOcc 0
32 mol 100 unq 5 iso 0 dist 9.56324 13.0353 8.86688 15.7025 8.72704 15.9331 numMergedOcc 0
33 mol 100 unq 6 iso 0 dist 5.70279 5.92158 7.47343 11.8754 7.75343 15.209 numMergedOcc 0
34 mol 100 unq 7 iso 0 dist 5.70279 5.85449 6.65086 11.8754 7.75343 10.9608 numMergedOcc 0
35 mol 100 unq 8 iso 0 dist 5.70279 7.68675 6.56369 11.8754 7.75343 5.69137 numMergedOcc 0
36 mol 100 unq 9 iso 0 dist 5.70279 9.53223 9.30209 11.8754 7.75343 9.21622 numMergedOcc 0
37 mol 102 unq 0 iso 0 dist 9.84673 5.09542 7.36792 7.6114 9.94856 5.498 numMergedOcc 0
38 mol 109 unq 0 iso 0 dist 8.84523 14.7654 8.69985 5.38332 5.87358 9.46098 numMergedOcc 0
39 mol 115 unq 0 iso 0 dist 8.97043 11.8721 9.33865 7.266 9.66954 6.09023 numMergedOcc 0
40 mol 115 unq 1 iso 0 dist 8.97043 11.8721 9.33865 11.6637 7.64585 10.2377 numMergedOcc 0
41 mol 115 unq 2 iso 0 dist 8.97043 5.19652 6.11741 7.266 9.66954 4.61908 numMergedOcc 0
42 mol 115 unq 3 iso 0 dist 8.97043 5.19652 6.11741 11.6637 7.64585 10.8939 numMergedOcc 0
43 mol 115 unq 4 iso 0 dist 6.04412 5.24229 4.99221 5.97684 6.50039 5.60178 numMergedOcc 0
44 mol 117 unq 0 iso 0 dist 7.0318 8.12649 9.84395 5.70073 6.62561 11.3679 numMergedOcc 0
45 mol 117 unq 1 iso 0 dist 7.0318 5.21051 7.90328 5.70073 6.62561 4.91401 numMergedOcc 0
46 mol 119 unq 0 iso 0 dist 8.88255 10.5726 8.73993 10.06 9.63176 10.6679 numMergedOcc 0
47 mol 131 unq 0 iso 0 dist 8.99949 11.3502 6.85062 9.45501 6.91348 6.19596 numMergedOcc 0
48 mol 131 unq 1 iso 0 dist 8.99949 11.3502 6.85062 9.03202 9.51418 6.6499 numMergedOcc 0
49 mol 134 unq 0 iso 0 dist 7.27598 6.50005 6.37586 7.26771 5.42582 5.41704 numMergedOcc 0
50 mol 134 unq 1 iso 0 dist 7.27598 12.0971 9.71307 7.26771 5.42582 6.17103 numMergedOcc 0
51 mol 134 unq 2 iso 0 dist 5.57904 7.41837 6.54501 7.26771 8.6355 10.1448 numMergedOcc 0
52 mol 134 unq 3 iso 0 dist 5.57904 6.50005 6.49416 7.26771 8.6355 5.41704 numMergedOcc 0
53 mol 142 unq 0 iso 0 dist 9.14908 6.3846 5.31024 11.8956 9.07935 9.49653 numMergedOcc 0
54 mol 142 unq 1 iso 0 dist 9.14908 4.39297 7.26382 11.8956 9.07935 7.53854 numMergedOcc 0
55 mol 155 unq 0 iso 0 dist 5.68636 7.92939 6.43582 7.441 9.38946 12.8482 numMergedOcc 0
56 mol 155 unq 1 iso 0 dist 5.68636 7.92939 6.43582 6.79302 7.36102 8.27726 numMergedOcc 0
57 mol 156 unq 0 iso 0 dist 9.19499 5.66289 7.44554 11.9162 9.36805 6.29785 numMergedOcc 0
58 mol 156 unq 1 iso 0 dist 7.98018 4.68187 9.83699 4.71629 7.55203 6.29785 numMergedOcc 0
59 mol 209 unq 0 iso 0 dist 6.14896 9.80484 7.56373 4.86181 7.95911 7.19056 numMergedOcc 0
60 mol 209 unq 1 iso 0 dist 9.12289 11.2544 7.56373 7.37293 7.95911 7.19056 numMergedOcc 0
61 mol 220 unq 0 iso 0 dist 6.21273 5.1021 9.23153 5.33649 6.84247 6.7067 numMergedOcc 0
62 mol 220 unq 1 iso 0 dist 6.21273 5.1021 9.23153 12.5011 6.99002 15.9568 numMergedOcc 0
63 mol 220 unq 2 iso 0 dist 6.21273 6.29601 8.24498 5.33649 6.84247 6.05129 numMergedOcc 0
64 mol 220 unq 3 iso 0 dist 6.21273 6.29601 8.24498 12.5011 6.99002 11.1321 numMergedOcc 0
65 mol 222 unq 0 iso 0 dist 5.47561 10.6375 8.01589 11.3364 6.82208 4.8892 numMergedOcc 0
66 mol 222 unq 1 iso 0 dist 5.47561 5.39098 7.7699 11.3364 6.82208 11.0074 numMergedOcc 0
67 mol 222 unq 2 iso 0 dist 5.47561 5.60111 7.21333 11.3364 6.82208 12.2813 numMergedOcc 0
68 mol 222 unq 3 iso 0 dist 8.5834 5.01062 7.54212 4.78647 7.18956 7.61682 numMergedOcc 0
69 mol 224 unq 0 iso 0 dist 9.73411 14.1073 8.95269 9.9234 6.87664 7.98696 numMergedOcc 0
70 mol 224 unq 1 iso 0 dist 9.73411 9.81806 6.57273 9.9234 6.87664 7.12232 numMergedOcc 0
71 mol 224 unq 2 iso 0 dist 9.73411 5.99647 5.78342 9.9234 6.87664 5.3621 numMergedOcc 0
72 mol 224 unq 3 iso 0 dist 7.07564 11.8217 8.95269 4.92261 6.87664 7.98696 numMergedOcc 0
73 mol 224 unq 4 iso 0 dist 7.07564 10.8463 6.57273 4.92261 6.87664 7.12232 numMergedOcc 0
74 mol 224 unq 5 iso 0 dist 7.07564 5.44863 5.78342 4.92261 6.87664 5.3621 numMergedOcc 0
75 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 7.35206 8.17891 6.43754 numMergedOcc 0
76 mol 227 unq 1 iso 0 dist 9.60159 6.38287 7.09863 7.35206 8.17891 9.13836 numMergedOcc 0
77 mol 227 unq 2 iso 0 dist 7.71761 5.841 7.55216 10.1071 8.83563 11.662 numMergedOcc 0
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79 mol 238 unq 1 iso 0 dist 4.87108 7.45873 6.22714 5.61491 7.49471 5.17471 numMergedOcc 0
80 mol 238 unq 2 iso 0 dist 7.64276 7.45873 7.31233 13.9044 6.55759 10.4664 numMergedOcc 0
81 mol 238 unq 3 iso 0 dist 7.64276 7.45873 7.31233 13.3748 7.02475 11.2717 numMergedOcc 0
82 mol 238 unq 4 iso 0 dist 7.64276 7.45873 7.31233 11.6924 7.67322 12.6986 numMergedOcc 0
83 mol 238 unq 5 iso 0 dist 7.64276 7.45873 7.31233 5.61491 7.19008 5.17471 numMergedOcc 0
84 mol 238 unq 6 iso 0 dist 6.54455 5.17954 6.22714 6.74728 7.49471 5.17471 numMergedOcc 0
85 mol 252 unq 0 iso 0 dist 7.93609 7.59919 8.1148 5.3935 7.66365 4.23801 numMergedOcc 0
86 mol 252 unq 1 iso 0 dist 7.93609 9.76823 8.33025 5.3935 7.66365 9.37715 numMergedOcc 0
87 mol 256 unq 0 iso 0 dist 5.98967 6.64029 8.29103 6.25507 5.24676 4.22352 numMergedOcc 0
88 mol 259 unq 0 iso 0 dist 8.57619 5.43184 5.30224 5.4536 8.37865 5.31048 numMergedOcc 0
89 mol 261 unq 0 iso 0 dist 6.82526 10.9571 9.14619 5.74092 7.47164 7.49174 numMergedOcc 0
90 mol 261 unq 1 iso 0 dist 6.82526 10.3274 8.45658 5.74092 7.47164 5.22253 numMergedOcc 0
91 mol 265 unq 0 iso 0 dist 5.3051 11.4819 8.4218 6.10503 6.34034 6.43013 numMergedOcc 0
92 mol 272 unq 0 iso 0 dist 7.31993 7.33684 9.97651 13.7563 9.09992 10.841 numMergedOcc 0
93 mol 272 unq 1 iso 0 dist 7.31993 7.33684 9.97651 5.91451 6.16449 4.72202 numMergedOcc 0
94 mol 272 unq 2 iso 0 dist 7.31993 10.4451 8.46116 13.7563 9.09992 5.63139 numMergedOcc 0
95 mol 272 unq 3 iso 0 dist 7.31993 10.4451 8.46116 5.91451 6.16449 8.52877 numMergedOcc 0
96 mol 278 unq 0 iso 0 dist 8.83775 4.66992 8.44326 9.59763 6.35287 6.07447 numMergedOcc 0
