0 mol 26 unq 0 iso 0 dist 9.03539 10.4631 7.22361 13.053 11.3644 6.15893 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.50339 4.77336 7.22361 10.6968 11.3644 6.15893 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 7.61402 5.45932 7.21995 8.11293 5.79982 7.70625 numMergedOcc 0
3 mol 45 unq 1 iso 0 dist 7.61402 8.19237 9.62637 8.11293 5.79982 6.01423 numMergedOcc 0
4 mol 45 unq 2 iso 0 dist 8.11293 5.45932 7.70625 7.61402 5.79982 7.21995 numMergedOcc 0
5 mol 45 unq 3 iso 0 dist 8.11293 8.19237 6.01423 7.61402 5.79982 9.62637 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.36397 4.665 6.72712 6.58062 5.06359 5.39745 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 6.58062 4.665 5.39745 7.36397 5.06359 6.72712 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 8.90311 14.3305 6.51395 13.9013 12.0339 9.83981 numMergedOcc 0
9 mol 114 unq 1 iso 0 dist 8.90311 14.3305 6.51395 11.2872 7.50948 6.13559 numMergedOcc 0
10 mol 114 unq 2 iso 0 dist 7.81181 7.62766 5.79343 14.7904 7.68699 8.809 numMergedOcc 0
11 mol 116 unq 0 iso 0 dist 9.88812 7.11876 6.49383 13.6623 6.36898 7.35992 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.28362 6.3353 6.75145 8.84246 9.10698 8.84087 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.28362 6.3353 6.75145 10.3153 8.71104 6.32615 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 8.28362 6.3353 6.75145 10.8942 5.63949 7.73791 numMergedOcc 0
15 mol 134 unq 3 iso 0 dist 8.28362 6.3353 6.75145 5.60137 5.2179 8.1856 numMergedOcc 0
16 mol 134 unq 4 iso 0 dist 5.60137 6.3353 8.1856 8.84246 7.12323 8.84087 numMergedOcc 0
17 mol 134 unq 5 iso 0 dist 5.60137 6.3353 8.1856 10.3153 9.82847 6.32615 numMergedOcc 0
18 mol 134 unq 6 iso 0 dist 5.60137 6.3353 8.1856 10.8942 8.00678 7.73791 numMergedOcc 0
19 mol 134 unq 7 iso 0 dist 5.60137 6.3353 8.1856 8.28362 5.2179 6.75145 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 8.10681 6.69013 4.25566 4.69823 7.41037 6.63171 numMergedOcc 0
21 mol 141 unq 1 iso 0 dist 8.10681 6.69013 4.25566 10.3062 6.97263 7.67273 numMergedOcc 0
22 mol 141 unq 2 iso 0 dist 4.69823 6.69013 6.63171 8.10681 7.41037 4.25566 numMergedOcc 0
23 mol 141 unq 3 iso 0 dist 4.69823 6.69013 6.63171 10.3062 6.23867 7.67273 numMergedOcc 0
24 mol 159 unq 0 iso 0 dist 6.68441 9.90351 8.52082 10.4366 7.97065 5.9032 numMergedOcc 0
25 mol 175 unq 0 iso 0 dist 9.21278 5.81919 9.19117 10.3967 7.48559 6.26365 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 9.30874 6.56225 9.06217 5.54873 5.3528 7.13252 numMergedOcc 0
27 mol 181 unq 1 iso 0 dist 5.54873 6.56225 7.13252 9.30874 5.3528 9.06217 numMergedOcc 0
28 mol 181 unq 2 iso 0 dist 9.7281 12.6646 8.9289 13.3613 6.46849 5.97685 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 7.90344 5.11183 8.90076 11.8385 12.6844 6.87131 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 7.90344 5.11183 8.90076 11.5829 10.9258 8.09718 numMergedOcc 0
31 mol 238 unq 2 iso 0 dist 7.90344 6.32646 6.62002 11.8385 12.6844 9.69818 numMergedOcc 0
32 mol 238 unq 3 iso 0 dist 7.90344 6.32646 6.62002 11.5829 10.9258 6.73446 numMergedOcc 0
33 mol 238 unq 4 iso 0 dist 9.83326 15.2051 8.09718 15.714 10.9258 8.90076 numMergedOcc 0
34 mol 238 unq 5 iso 0 dist 9.83326 15.2051 8.09718 14.8204 5.38691 6.87131 numMergedOcc 0
35 mol 238 unq 6 iso 0 dist 9.83326 10.3525 6.73446 15.714 10.9258 6.62002 numMergedOcc 0
36 mol 238 unq 7 iso 0 dist 9.83326 10.3525 6.73446 14.8204 5.38691 9.69818 numMergedOcc 0
37 mol 238 unq 8 iso 0 dist 6.19514 13.5391 8.09718 12.5166 10.9258 8.90076 numMergedOcc 0
38 mol 238 unq 9 iso 0 dist 6.19514 13.5391 8.09718 11.0822 5.38691 6.87131 numMergedOcc 0
39 mol 238 unq 10 iso 0 dist 6.19514 9.75263 6.73446 12.5166 10.9258 6.62002 numMergedOcc 0
40 mol 238 unq 11 iso 0 dist 6.19514 9.75263 6.73446 11.0822 5.38691 9.69818 numMergedOcc 0
41 mol 259 unq 0 iso 0 dist 9.418 4.34105 8.92185 9.26725 4.85051 7.7574 numMergedOcc 0
42 mol 259 unq 1 iso 0 dist 8.10823 11.2938 8.92185 12.1817 4.85051 7.7574 numMergedOcc 0
43 mol 259 unq 2 iso 0 dist 8.84139 4.32336 7.7574 11.4584 4.85051 8.92185 numMergedOcc 0
44 mol 259 unq 3 iso 0 dist 9.26725 4.34105 7.7574 9.418 4.85051 8.92185 numMergedOcc 0
