0 mol 1 unq 0 iso 0 dist 5.74199 8.69605 10.4572 6.2936 10.4951 5.19589 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 9.26685 9.5937 5.4483 9.78918 14.8435 14.6638 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 9.26685 9.5937 5.4483 6.80314 14.487 12.7368 numMergedOcc 0
3 mol 17 unq 2 iso 0 dist 9.26685 7.34681 9.4204 9.78918 14.8435 16.9932 numMergedOcc 0
4 mol 17 unq 3 iso 0 dist 9.26685 7.34681 9.4204 6.80314 14.487 13.5569 numMergedOcc 0
5 mol 29 unq 0 iso 0 dist 7.71924 5.36278 8.02814 8.9204 4.40181 7.29489 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 7.83595 8.204 10.5615 8.90581 5.02236 8.50024 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 8.36915 9.53081 13.2937 6.42242 13.1229 5.84184 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 6.01454 9.53081 5.41488 6.42242 6.98858 5.84184 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 6.08228 5.66803 5.88036 9.23947 11.3115 8.95689 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 8.4438 7.58027 9.96367 6.82707 7.94629 12.5165 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 8.4438 4.34694 9.65371 6.82707 7.94629 10.5011 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 7.99438 9.30887 14.0351 numMergedOcc 0
13 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 6.64915 11.3722 13.4228 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 6.93893 9.0185 5.06999 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 8.34427 9.52061 7.12885 7.32407 4.68204 7.72162 numMergedOcc 0
16 mol 129 unq 1 iso 0 dist 8.34427 9.52061 7.12885 6.48695 9.09658 7.95267 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 7.85526 9.88178 6.01484 7.50264 9.66528 13.5143 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 5.33543 9.88178 10.6104 7.50264 5.45341 13.5143 numMergedOcc 0
19 mol 147 unq 0 iso 0 dist 9.13646 5.32865 4.61905 8.40219 7.24469 5.30729 numMergedOcc 0
20 mol 162 unq 0 iso 0 dist 8.954 6.59407 7.84996 6.80226 4.55978 4.93161 numMergedOcc 0
21 mol 165 unq 0 iso 0 dist 9.59989 6.85551 9.94274 5.79029 9.33914 6.57529 numMergedOcc 0
22 mol 171 unq 0 iso 0 dist 9.47945 6.19457 10.2353 6.4751 15.864 9.13204 numMergedOcc 0
23 mol 171 unq 1 iso 0 dist 9.47945 6.19457 10.2353 5.75085 14.3848 6.62952 numMergedOcc 0
24 mol 198 unq 0 iso 0 dist 4.58291 8.51153 3.96154 8.28295 5.47473 5.3597 numMergedOcc 0
25 mol 204 unq 0 iso 0 dist 7.00683 9.52029 8.61406 9.46973 6.08392 4.29037 numMergedOcc 0
26 mol 220 unq 0 iso 0 dist 7.86207 9.89039 9.09963 7.46122 4.39102 9.36068 numMergedOcc 0
27 mol 220 unq 1 iso 0 dist 7.86207 8.57174 14.3078 7.46122 4.39102 15.6078 numMergedOcc 0
28 mol 220 unq 2 iso 0 dist 7.57712 5.25149 10.1832 8.75712 11.317 10.8928 numMergedOcc 0
29 mol 220 unq 3 iso 0 dist 7.57712 8.6368 13.4455 8.75712 11.317 4.03653 numMergedOcc 0
30 mol 220 unq 4 iso 0 dist 7.20255 5.25149 9.96224 8.75712 5.72178 10.8928 numMergedOcc 0
31 mol 220 unq 5 iso 0 dist 7.20255 8.6368 8.70221 8.75712 5.72178 4.03653 numMergedOcc 0
32 mol 220 unq 6 iso 0 dist 7.57716 6.50756 8.34243 8.32948 4.45003 11.1785 numMergedOcc 0
33 mol 220 unq 7 iso 0 dist 8.98362 6.50756 5.82963 8.32948 14.9758 11.1785 numMergedOcc 0
34 mol 226 unq 0 iso 0 dist 7.20862 8.74399 12.3908 5.3747 8.58832 7.20864 numMergedOcc 0
35 mol 230 unq 0 iso 0 dist 6.88683 9.24729 11.0843 8.85051 5.50843 9.16476 numMergedOcc 0
36 mol 236 unq 0 iso 0 dist 7.6402 7.74348 13.5224 8.88405 8.43621 8.64384 numMergedOcc 0
37 mol 236 unq 1 iso 0 dist 7.6402 7.74348 13.5224 7.13854 6.96377 9.7977 numMergedOcc 0
38 mol 239 unq 0 iso 0 dist 8.34832 8.48545 14.2079 6.91534 15.1473 9.08479 numMergedOcc 0
39 mol 239 unq 1 iso 0 dist 8.34832 8.48545 14.2079 8.67704 16.5164 5.88166 numMergedOcc 0
40 mol 244 unq 0 iso 0 dist 6.51428 7.43391 4.69664 9.97458 16.0237 16.3 numMergedOcc 0
41 mol 244 unq 1 iso 0 dist 6.51428 7.79787 13.4155 9.97458 16.0237 4.89551 numMergedOcc 0
42 mol 261 unq 0 iso 0 dist 9.70222 4.85199 10.6318 6.45102 5.48108 5.52134 numMergedOcc 0
43 mol 261 unq 1 iso 0 dist 9.70222 9.72159 4.97878 6.45102 5.48108 7.0673 numMergedOcc 0
44 mol 261 unq 2 iso 0 dist 9.71882 9.13604 10.6318 9.20425 5.48108 5.52134 numMergedOcc 0
45 mol 261 unq 3 iso 0 dist 9.71882 6.89731 4.97878 9.20425 5.48108 7.0673 numMergedOcc 0
46 mol 261 unq 4 iso 0 dist 9.71882 9.85607 9.35886 9.20425 5.48108 9.06697 numMergedOcc 0
47 mol 266 unq 0 iso 0 dist 8.61786 8.8646 9.94141 9.54381 5.4894 14.5123 numMergedOcc 0
48 mol 266 unq 1 iso 0 dist 8.42706 8.8646 3.93133 9.54381 15.3099 14.5123 numMergedOcc 0
49 mol 279 unq 0 iso 0 dist 5.78017 8.03486 7.78018 9.29922 13.4771 15.4124 numMergedOcc 0
50 mol 279 unq 1 iso 0 dist 8.78203 8.03486 5.38411 9.29922 12.7014 15.4124 numMergedOcc 0
51 mol 282 unq 0 iso 0 dist 8.61456 5.00258 9.80233 7.84236 10.9966 4.0078 numMergedOcc 0
52 mol 282 unq 1 iso 0 dist 8.61456 9.98886 4.68809 7.84236 10.9966 12.9261 numMergedOcc 0
