0 mol 25 unq 0 iso 0 dist 7.03345 9.07927 9.39124 12.3669 13.5703 9.87281 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 7.03345 8.50987 7.11047 12.3669 13.5703 7.63928 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 5.2296 9.07927 11.898 12.3669 16.1757 9.87281 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 5.2296 8.50987 10.7715 12.3669 16.1757 7.63928 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.27623 8.46313 7.13676 3.88133 7.63159 7.52103 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 7.27623 8.46313 7.13676 12.1397 10.8872 8.46556 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.76184 9.79714 8.73236 3.80683 9.33989 9.71952 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 9.76184 9.79714 8.73236 6.77296 8.57953 7.28257 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 9.49371 5.17291 7.84269 4.73724 13.7382 8.09199 numMergedOcc 0
9 mol 76 unq 3 iso 0 dist 9.49371 5.17291 7.84269 3.98395 8.92491 7.47794 numMergedOcc 0
10 mol 76 unq 4 iso 0 dist 5.05941 8.81569 7.84269 12.5763 13.7382 8.09199 numMergedOcc 0
11 mol 76 unq 5 iso 0 dist 5.05941 8.81569 7.84269 10.3277 8.92491 7.47794 numMergedOcc 0
12 mol 101 unq 0 iso 0 dist 8.70947 7.42893 9.80321 4.58154 9.83562 5.22543 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 5.92115 9.06272 6.13737 4.02665 5.16531 6.38163 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 5.50699 7.85025 9.74121 13.039 15.5644 5.82404 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 9.92707 7.18765 6.04016 14.6497 10.219 8.3337 numMergedOcc 0
16 mol 197 unq 1 iso 0 dist 6.22734 7.18765 7.17757 14.6497 14.3216 8.3337 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 9.89918 4.71754 6.36617 6.24332 13.6008 7.75084 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 6.88579 9.14351 14.2876 8.05633 14.8578 6.37672 numMergedOcc 0
19 mol 249 unq 1 iso 0 dist 6.88579 9.14351 14.2876 6.09778 12.5747 8.94023 numMergedOcc 0
20 mol 249 unq 2 iso 0 dist 7.30848 9.14351 12.8314 8.05633 13.5546 6.37672 numMergedOcc 0
21 mol 249 unq 3 iso 0 dist 7.30848 9.14351 12.8314 6.09778 12.9733 8.94023 numMergedOcc 0
22 mol 257 unq 0 iso 0 dist 8.68995 5.13633 6.25954 12.611 14.4981 9.83721 numMergedOcc 0
23 mol 271 unq 0 iso 0 dist 8.56431 7.59727 5.49799 3.76546 10.0868 9.56149 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.36667 9.60619 9.98703 15.5414 15.9383 7.74162 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 6.74021 9.60619 11.6718 15.5414 19.1242 7.74162 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 8.23483 6.87804 11.5813 12.1872 19.4717 9.20416 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 8.23483 6.87804 11.5813 12.2904 17.5609 7.53641 numMergedOcc 0
28 mol 292 unq 2 iso 0 dist 9.21126 6.07571 8.50714 11.4534 17.4952 9.20416 numMergedOcc 0
29 mol 292 unq 3 iso 0 dist 9.21126 6.07571 8.50714 4.49811 11.5135 7.53641 numMergedOcc 0
