0 mol 9 unq 0 iso 0 dist 6.17406 10.8146 7.35972 10.5868 5.43306 9.93542 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.2707 12.0297 7.35972 8.99816 5.43306 9.93542 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.99816 12.0297 9.93542 7.2707 5.43306 7.35972 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 5.64906 8.85817 7.92012 11.4262 7.31113 7.25951 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 6.85224 4.53009 4.74809 8.04657 9.9801 7.43882 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 6.85224 4.53009 4.74809 9.58483 5.64041 7.31198 numMergedOcc 0
6 mol 20 unq 2 iso 0 dist 6.85224 5.095 5.86181 8.04657 9.9801 6.3253 numMergedOcc 0
7 mol 20 unq 3 iso 0 dist 6.85224 5.095 5.86181 9.58483 5.64041 5.80568 numMergedOcc 0
8 mol 20 unq 4 iso 0 dist 8.04657 4.53009 7.43882 6.85224 9.9801 4.74809 numMergedOcc 0
9 mol 20 unq 5 iso 0 dist 8.04657 4.53009 7.43882 9.58483 7.57412 7.31198 numMergedOcc 0
10 mol 20 unq 6 iso 0 dist 8.04657 5.095 6.3253 6.85224 9.9801 5.86181 numMergedOcc 0
11 mol 20 unq 7 iso 0 dist 8.04657 5.095 6.3253 9.58483 7.57412 5.80568 numMergedOcc 0
12 mol 20 unq 8 iso 0 dist 6.70097 10.3521 5.86181 11.5741 6.05053 4.74809 numMergedOcc 0
13 mol 20 unq 9 iso 0 dist 6.70097 8.19819 6.3253 11.5741 6.05053 7.43882 numMergedOcc 0
14 mol 20 unq 10 iso 0 dist 6.70097 6.11738 5.80568 11.5741 6.05053 7.31198 numMergedOcc 0
15 mol 24 unq 0 iso 0 dist 6.23824 6.39466 6.72323 11.978 9.92026 5.95834 numMergedOcc 0
16 mol 24 unq 1 iso 0 dist 6.23824 6.39466 6.72323 9.27694 6.16544 4.2121 numMergedOcc 0
17 mol 24 unq 2 iso 0 dist 6.23824 6.39466 6.72323 11.3404 10.2653 8.00171 numMergedOcc 0
18 mol 92 unq 0 iso 0 dist 9.81484 6.60364 6.77241 5.77527 6.2185 5.50508 numMergedOcc 0
19 mol 92 unq 1 iso 0 dist 5.77527 6.60364 5.50508 9.81484 6.2185 6.77241 numMergedOcc 0
20 mol 100 unq 0 iso 0 dist 6.84692 4.71426 9.5057 5.74152 5.59227 5.75014 numMergedOcc 0
21 mol 100 unq 1 iso 0 dist 5.74152 4.71426 5.75014 6.84692 5.59227 9.5057 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 7.84048 4.29098 6.84835 12.6038 9.63809 8.42748 numMergedOcc 0
23 mol 171 unq 0 iso 0 dist 7.03303 7.23254 5.25109 13.4146 7.9115 7.22518 numMergedOcc 0
24 mol 171 unq 1 iso 0 dist 7.03303 8.97143 8.21618 13.4146 7.9115 7.58499 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 8.91675 10.0785 7.32087 12.2464 9.87773 8.86197 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 9.02735 9.68794 8.26288 15.009 9.52218 6.60053 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 5.67863 9.82808 6.38324 9.42308 9.4131 6.1886 numMergedOcc 0
28 mol 194 unq 1 iso 0 dist 9.42308 9.82808 6.1886 5.67863 9.4131 6.38324 numMergedOcc 0
29 mol 244 unq 0 iso 0 dist 6.61951 5.01275 6.22122 11.2975 10.6423 7.95359 numMergedOcc 0
30 mol 256 unq 0 iso 0 dist 6.65749 4.51747 4.98734 4.73652 4.56465 6.37963 numMergedOcc 0
31 mol 256 unq 1 iso 0 dist 6.65749 4.51747 4.98734 12.0819 8.02729 8.16803 numMergedOcc 0
32 mol 256 unq 2 iso 0 dist 6.65749 4.74632 6.33496 4.73652 4.56465 6.00636 numMergedOcc 0
33 mol 256 unq 3 iso 0 dist 6.65749 4.74632 6.33496 12.3046 9.60398 7.81448 numMergedOcc 0
34 mol 256 unq 4 iso 0 dist 6.65749 4.74632 6.33496 11.9204 7.37964 8.54499 numMergedOcc 0
35 mol 256 unq 5 iso 0 dist 4.73652 4.51747 6.37963 6.65749 4.56465 4.98734 numMergedOcc 0
36 mol 256 unq 6 iso 0 dist 4.73652 4.51747 6.37963 12.0819 12.3316 8.16803 numMergedOcc 0
37 mol 256 unq 7 iso 0 dist 4.73652 4.74632 6.00636 6.65749 4.56465 6.33496 numMergedOcc 0
38 mol 256 unq 8 iso 0 dist 4.73652 4.74632 6.00636 12.3046 11.7084 7.81448 numMergedOcc 0
39 mol 256 unq 9 iso 0 dist 4.73652 4.74632 6.00636 11.9204 10.9861 8.54499 numMergedOcc 0
