0 mol 7 unq 0 iso 0 dist 8.41173 7.38748 10.1841 5.13744 10.2446 8.77133 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.00925 8.68949 16.2669 6.88402 15.3607 8.70858 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 8.84148 5.52834 5.21506 6.79455 11.6888 6.51963 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 6.08228 5.66803 5.88036 10.0913 12.174 7.77991 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 6.08228 5.66803 5.88036 5.68492 9.82635 5.1488 numMergedOcc 0
5 mol 64 unq 2 iso 0 dist 9.86958 8.85416 5.88036 8.21081 12.174 7.77991 numMergedOcc 0
6 mol 64 unq 3 iso 0 dist 9.86958 8.85416 5.88036 11.6323 9.82635 5.1488 numMergedOcc 0
7 mol 64 unq 4 iso 0 dist 7.8986 8.52643 7.05519 11.5903 9.14856 7.7933 numMergedOcc 0
8 mol 64 unq 5 iso 0 dist 7.24183 5.41357 7.05519 6.10515 9.14856 7.7933 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.27331 7.45777 4.68175 7.17416 11.9113 8.49022 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 15.6024 15.8071 9.74201 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 13.7118 17.0146 8.17967 numMergedOcc 0
12 mol 87 unq 0 iso 0 dist 9.10245 9.90256 5.83874 7.62644 12.6881 9.53368 numMergedOcc 0
13 mol 87 unq 1 iso 0 dist 9.10245 9.90256 5.83874 10.8096 11.2241 6.54532 numMergedOcc 0
14 mol 90 unq 0 iso 0 dist 6.6146 9.06641 5.12529 4.46847 9.05357 8.95044 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 9.6874 6.54778 4.84565 5.84883 10.8293 6.06039 numMergedOcc 0
16 mol 114 unq 1 iso 0 dist 9.6874 6.54778 4.84565 10.9953 13.5042 9.36502 numMergedOcc 0
17 mol 129 unq 0 iso 0 dist 8.34427 9.52061 7.12885 9.66773 11.2007 9.50776 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 9.07294 5.79195 5.35551 7.50288 10.4324 8.03691 numMergedOcc 0
19 mol 133 unq 1 iso 0 dist 5.12189 9.2759 10.8516 8.01541 8.49888 8.03691 numMergedOcc 0
20 mol 133 unq 2 iso 0 dist 7.50126 9.2759 5.35551 8.01541 10.4324 8.03691 numMergedOcc 0
21 mol 147 unq 0 iso 0 dist 9.13646 5.32865 4.61905 10.7118 11.4803 9.80032 numMergedOcc 0
22 mol 148 unq 0 iso 0 dist 9.71692 9.18753 11.8278 6.16168 11.144 9.21934 numMergedOcc 0
23 mol 150 unq 0 iso 0 dist 9.73708 9.15244 11.6537 6.14967 11.1402 9.13113 numMergedOcc 0
24 mol 159 unq 0 iso 0 dist 7.60912 6.86212 8.83633 3.90437 11.3079 9.23757 numMergedOcc 0
25 mol 162 unq 0 iso 0 dist 8.954 6.59407 7.84996 8.08223 14.5486 8.8048 numMergedOcc 0
26 mol 165 unq 0 iso 0 dist 8.2197 7.21397 10.5947 9.55225 10.0594 8.45742 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 6.47689 9.40718 5.15002 10.602 10.2559 9.23089 numMergedOcc 0
28 mol 183 unq 0 iso 0 dist 7.69421 8.97652 9.01399 13.7069 16.5717 8.55287 numMergedOcc 0
29 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 9.77203 13.0019 7.46024 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 7.47122 7.03925 4.49347 11.3098 9.04427 7.26162 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 7.58998 6.23677 6.88745 4.10214 4.64336 7.49889 numMergedOcc 0
32 mol 224 unq 2 iso 0 dist 7.58998 6.23677 6.88745 6.78713 12.5784 9.89345 numMergedOcc 0
33 mol 230 unq 0 iso 0 dist 6.88683 9.24729 11.0843 10.2514 14.2362 7.08409 numMergedOcc 0
34 mol 239 unq 0 iso 0 dist 6.00654 8.86185 8.20191 7.57139 10.4752 6.98781 numMergedOcc 0
35 mol 266 unq 0 iso 0 dist 9.63694 6.57444 13.1376 5.53503 14.7501 9.35019 numMergedOcc 0
36 mol 266 unq 1 iso 0 dist 9.77392 9.62494 18.9489 12.9391 21.2727 9.85022 numMergedOcc 0
37 mol 266 unq 2 iso 0 dist 6.58277 6.57444 5.91091 5.53503 6.36049 9.35019 numMergedOcc 0
38 mol 266 unq 3 iso 0 dist 8.12204 9.39714 5.91091 11.3259 6.36049 9.35019 numMergedOcc 0
39 mol 282 unq 0 iso 0 dist 8.61456 9.98886 4.68809 10.1569 9.79549 5.98155 numMergedOcc 0
40 mol 282 unq 1 iso 0 dist 8.41041 6.81887 4.68809 4.54514 9.79549 5.98155 numMergedOcc 0
