0 mol 24 unq 0 iso 0 dist 8.62284 5.90981 9.69752 6.72423 9.41655 7.02381 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.62284 5.90981 9.69752 4.0664 6.803 7.18485 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.62284 13.719 9.36461 6.72423 9.41655 14.1137 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.62284 13.719 9.36461 4.0664 6.803 13.4584 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 6.93364 6.45654 6.15801 3.8237 9.31883 9.92713 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 6.93364 6.45654 6.15801 6.07532 9.475 10.6518 numMergedOcc 0
6 mol 34 unq 2 iso 0 dist 6.93364 6.45654 6.15801 4.47743 8.34011 5.94977 numMergedOcc 0
7 mol 34 unq 3 iso 0 dist 6.93364 6.45654 6.15801 11.418 6.29842 6.35031 numMergedOcc 0
8 mol 34 unq 4 iso 0 dist 6.93364 11.9626 9.63403 3.8237 9.31883 15.7295 numMergedOcc 0
9 mol 34 unq 5 iso 0 dist 6.93364 11.9626 9.63403 6.07532 9.475 16.8534 numMergedOcc 0
10 mol 34 unq 6 iso 0 dist 6.93364 11.9626 9.63403 4.47743 8.34011 12.3865 numMergedOcc 0
11 mol 34 unq 7 iso 0 dist 6.93364 11.9626 9.63403 11.418 6.29842 5.50427 numMergedOcc 0
12 mol 34 unq 8 iso 0 dist 6.93364 14.1223 8.07314 3.8237 9.31883 16.4972 numMergedOcc 0
13 mol 34 unq 9 iso 0 dist 6.93364 14.1223 8.07314 6.07532 9.475 15.5365 numMergedOcc 0
14 mol 34 unq 10 iso 0 dist 6.93364 14.1223 8.07314 4.47743 8.34011 13.3825 numMergedOcc 0
15 mol 34 unq 11 iso 0 dist 6.93364 14.1223 8.07314 11.418 6.29842 5.12822 numMergedOcc 0
16 mol 34 unq 12 iso 0 dist 6.34821 7.35043 6.15801 4.97937 9.31883 9.92713 numMergedOcc 0
17 mol 34 unq 13 iso 0 dist 6.34821 7.35043 6.15801 3.68737 9.475 10.6518 numMergedOcc 0
18 mol 34 unq 14 iso 0 dist 6.34821 7.35043 6.15801 3.93021 8.34011 5.94977 numMergedOcc 0
19 mol 34 unq 15 iso 0 dist 6.34821 7.35043 6.15801 11.1366 6.29842 6.35031 numMergedOcc 0
20 mol 34 unq 16 iso 0 dist 6.34821 13.4874 9.63403 4.97937 9.31883 15.7295 numMergedOcc 0
21 mol 34 unq 17 iso 0 dist 6.34821 13.4874 9.63403 3.68737 9.475 16.8534 numMergedOcc 0
22 mol 34 unq 18 iso 0 dist 6.34821 13.4874 9.63403 3.93021 8.34011 12.3865 numMergedOcc 0
23 mol 34 unq 19 iso 0 dist 6.34821 13.4874 9.63403 11.1366 6.29842 5.50427 numMergedOcc 0
24 mol 34 unq 20 iso 0 dist 6.34821 12.0754 8.07314 4.97937 9.31883 16.4972 numMergedOcc 0
25 mol 34 unq 21 iso 0 dist 6.34821 12.0754 8.07314 3.68737 9.475 15.5365 numMergedOcc 0
26 mol 34 unq 22 iso 0 dist 6.34821 12.0754 8.07314 3.93021 8.34011 13.3825 numMergedOcc 0
27 mol 34 unq 23 iso 0 dist 6.34821 12.0754 8.07314 11.1366 6.29842 5.12822 numMergedOcc 0
28 mol 90 unq 0 iso 0 dist 7.54496 4.48233 7.31784 9.67572 9.08732 5.97902 numMergedOcc 0
29 mol 92 unq 0 iso 0 dist 9.20197 10.7055 8.57827 11.6562 7.87729 4.15826 numMergedOcc 0
30 mol 92 unq 1 iso 0 dist 9.20197 6.91947 7.94453 11.6562 7.87729 10.1482 numMergedOcc 0
31 mol 93 unq 0 iso 0 dist 7.85041 6.957 7.62611 11.5028 6.46217 6.4154 numMergedOcc 0
32 mol 147 unq 0 iso 0 dist 5.1101 10.7872 7.25644 7.97454 7.19893 13.5462 numMergedOcc 0
33 mol 147 unq 1 iso 0 dist 5.1101 10.7872 7.25644 3.547 6.37938 13.2259 numMergedOcc 0
34 mol 147 unq 2 iso 0 dist 7.01133 7.66774 7.25644 13.3536 7.19893 13.5462 numMergedOcc 0
35 mol 147 unq 3 iso 0 dist 7.01133 7.66774 7.25644 9.88741 6.37938 13.2259 numMergedOcc 0
36 mol 151 unq 0 iso 0 dist 5.63814 8.3622 4.74531 4.26123 9.06016 11.8889 numMergedOcc 0
37 mol 158 unq 0 iso 0 dist 6.39981 5.42969 6.76055 5.30823 8.06621 9.64397 numMergedOcc 0
38 mol 158 unq 1 iso 0 dist 6.39981 4.77562 9.36343 5.30823 8.06621 5.16839 numMergedOcc 0
39 mol 163 unq 0 iso 0 dist 8.21476 15.4471 9.79069 11.6682 7.69757 6.5925 numMergedOcc 0
40 mol 163 unq 1 iso 0 dist 8.21476 9.33755 9.27496 11.6682 7.69757 15.5126 numMergedOcc 0
41 mol 163 unq 2 iso 0 dist 7.66897 9.54216 9.79069 7.1982 7.69757 6.5925 numMergedOcc 0
42 mol 163 unq 3 iso 0 dist 7.66897 10.7572 9.27496 7.1982 7.69757 15.5126 numMergedOcc 0
43 mol 175 unq 0 iso 0 dist 7.01126 4.30489 5.89564 5.31608 6.90373 3.6642 numMergedOcc 0
44 mol 175 unq 1 iso 0 dist 7.01126 4.57622 5.60528 5.31608 6.90373 6.03236 numMergedOcc 0
45 mol 182 unq 0 iso 0 dist 8.89822 11.9845 8.2169 15.2041 8.62437 7.36876 numMergedOcc 0
46 mol 182 unq 1 iso 0 dist 8.89822 11.9845 8.2169 9.61248 7.07405 4.17332 numMergedOcc 0
47 mol 182 unq 2 iso 0 dist 8.89822 12.8718 8.52103 15.2041 8.62437 3.73864 numMergedOcc 0
48 mol 182 unq 3 iso 0 dist 8.89822 12.8718 8.52103 9.61248 7.07405 3.85553 numMergedOcc 0
49 mol 205 unq 0 iso 0 dist 5.42696 11.8917 9.17946 3.72865 5.19567 13.6793 numMergedOcc 0
50 mol 210 unq 0 iso 0 dist 6.4829 5.96222 5.57779 3.82667 8.83523 5.88175 numMergedOcc 0
51 mol 210 unq 1 iso 0 dist 6.4829 10.1011 7.05649 3.82667 8.83523 9.89707 numMergedOcc 0
52 mol 210 unq 2 iso 0 dist 6.4829 12.5026 6.78579 3.82667 8.83523 13.4242 numMergedOcc 0
53 mol 213 unq 0 iso 0 dist 7.37935 9.84448 8.42053 10.4239 7.79105 4.40538 numMergedOcc 0
54 mol 218 unq 0 iso 0 dist 6.86795 5.89482 8.3087 4.24855 8.98941 8.98584 numMergedOcc 0
55 mol 218 unq 1 iso 0 dist 6.86795 5.89482 8.3087 5.31276 6.45381 3.90135 numMergedOcc 0
56 mol 218 unq 2 iso 0 dist 6.61099 6.65167 8.3087 10.7049 8.98941 8.98584 numMergedOcc 0
57 mol 218 unq 3 iso 0 dist 6.61099 6.65167 8.3087 4.36581 6.45381 3.90135 numMergedOcc 0
58 mol 234 unq 0 iso 0 dist 9.06084 6.56416 6.00582 6.12476 6.58003 3.64991 numMergedOcc 0
59 mol 237 unq 0 iso 0 dist 7.33613 4.7134 6.07878 5.11578 8.96803 4.50383 numMergedOcc 0
60 mol 237 unq 1 iso 0 dist 7.33613 4.7134 6.07878 13.2415 7.95072 11.9967 numMergedOcc 0
61 mol 237 unq 2 iso 0 dist 7.33613 6.42587 7.80422 5.11578 8.96803 9.41259 numMergedOcc 0
62 mol 237 unq 3 iso 0 dist 7.33613 6.42587 7.80422 13.2415 7.95072 9.68512 numMergedOcc 0
63 mol 237 unq 4 iso 0 dist 7.33613 9.55218 5.06628 5.11578 8.96803 12.5736 numMergedOcc 0
64 mol 237 unq 5 iso 0 dist 7.33613 9.55218 5.06628 13.2415 7.95072 3.68966 numMergedOcc 0
65 mol 264 unq 0 iso 0 dist 9.42738 10.6815 7.21655 3.50016 8.78525 10.197 numMergedOcc 0
66 mol 277 unq 0 iso 0 dist 7.25677 6.56697 7.85414 6.50127 8.78893 12.1127 numMergedOcc 0
67 mol 277 unq 1 iso 0 dist 6.73126 9.00644 8.81717 6.50127 4.61089 11.6159 numMergedOcc 0
68 mol 282 unq 0 iso 0 dist 9.96468 6.18986 8.53065 14.9487 9.9322 9.21292 numMergedOcc 0
69 mol 282 unq 1 iso 0 dist 9.96468 9.09482 8.67489 14.9487 9.9322 17.93 numMergedOcc 0
70 mol 282 unq 2 iso 0 dist 9.59817 10.2999 8.53065 17.4495 9.9322 9.21292 numMergedOcc 0
71 mol 282 unq 3 iso 0 dist 9.59817 6.21176 8.67489 17.4495 9.9322 17.93 numMergedOcc 0
