0 mol 20 unq 0 iso 0 dist 4.90613 6.02975 4.71011 10.9288 9.14371 9.4228 13.4715 14.3246 9.74724 16.7341 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 4.90613 6.02975 4.71011 10.9288 9.14371 9.4228 12.9639 13.7531 9.13347 14.3516 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.94728 6.03041 10.5428 14.4605 16.6141 8.80127 11.1055 11.2267 7.18124 6.7846 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.94728 6.03041 10.5428 14.4605 16.6141 8.80127 11.2879 14.0874 6.47026 8.03955 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.94728 6.03041 10.5428 4.42703 11.1377 6.48457 11.1055 11.2267 7.18124 13.2846 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.94728 6.03041 10.5428 4.42703 11.1377 6.48457 11.2879 14.0874 6.47026 12.3897 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 9.33902 6.03041 11.5035 14.4605 17.5377 8.80127 11.1055 17.224 7.18124 6.7846 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 9.33902 6.03041 11.5035 14.4605 17.5377 8.80127 11.2879 17.9463 6.47026 8.03955 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 9.33902 6.03041 11.5035 4.42703 6.80849 6.48457 11.1055 17.224 7.18124 13.2846 numMergedOcc 0
9 mol 24 unq 7 iso 0 dist 9.33902 6.03041 11.5035 4.42703 6.80849 6.48457 11.2879 17.9463 6.47026 12.3897 numMergedOcc 0
10 mol 81 unq 0 iso 0 dist 7.91009 5.77889 6.17229 5.07603 11.5207 6.4687 3.88746 9.64621 7.15043 5.62545 numMergedOcc 0
11 mol 81 unq 1 iso 0 dist 7.91009 5.77889 6.17229 5.07603 11.5207 6.4687 3.3881 4.95504 5.70283 8.0518 numMergedOcc 0
12 mol 81 unq 2 iso 0 dist 7.91009 6.91587 8.36931 5.07603 11.5207 6.67147 3.88746 9.64621 5.86142 5.62545 numMergedOcc 0
13 mol 81 unq 3 iso 0 dist 7.91009 6.91587 8.36931 5.07603 11.5207 6.67147 3.3881 4.95504 7.16741 8.0518 numMergedOcc 0
14 mol 81 unq 4 iso 0 dist 4.39121 8.22976 6.17229 11.6734 11.5207 6.4687 7.86537 9.64621 7.15043 5.62545 numMergedOcc 0
15 mol 81 unq 5 iso 0 dist 4.39121 8.22976 6.17229 11.6734 11.5207 6.4687 3.93741 4.95504 5.70283 8.0518 numMergedOcc 0
16 mol 81 unq 6 iso 0 dist 4.39121 8.9512 8.36931 11.6734 11.5207 6.67147 7.86537 9.64621 5.86142 5.62545 numMergedOcc 0
17 mol 81 unq 7 iso 0 dist 4.39121 8.9512 8.36931 11.6734 11.5207 6.67147 3.93741 4.95504 7.16741 8.0518 numMergedOcc 0
18 mol 95 unq 0 iso 0 dist 6.4081 7.27074 3.8075 12.8517 12.5646 8.82395 5.47525 9.98215 9.36638 11.8395 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 6.21825 9.33188 9.29669 14.8911 14.8279 6.32146 12.3716 14.2842 5.60333 5.02061 numMergedOcc 0
20 mol 176 unq 1 iso 0 dist 6.21825 9.33188 9.29669 14.8911 14.8279 6.32146 12.7977 14.4383 5.58647 6.40668 numMergedOcc 0
21 mol 176 unq 2 iso 0 dist 6.21825 9.33188 9.29669 14.8911 14.8279 6.32146 12.1252 15.6878 8.5733 10.3398 numMergedOcc 0
22 mol 176 unq 3 iso 0 dist 8.95504 9.33188 5.73429 14.8911 11.5033 6.32146 12.3716 9.74525 5.60333 5.02061 numMergedOcc 0
23 mol 176 unq 4 iso 0 dist 8.95504 9.33188 5.73429 14.8911 11.5033 6.32146 12.7977 8.00223 5.58647 6.40668 numMergedOcc 0
24 mol 176 unq 5 iso 0 dist 8.95504 9.33188 5.73429 14.8911 11.5033 6.32146 12.1252 9.60695 8.5733 10.3398 numMergedOcc 0
25 mol 182 unq 0 iso 0 dist 7.37431 6.17569 7.45392 11.8631 15.765 9.07173 7.7167 13.3345 8.58391 6.1548 numMergedOcc 0
26 mol 252 unq 0 iso 0 dist 8.80432 9.76717 3.63907 10.2202 10.3367 7.48298 3.91089 10.3045 9.84342 7.63636 numMergedOcc 0
27 mol 252 unq 1 iso 0 dist 8.80432 9.76717 3.63907 10.2202 10.3367 7.48298 15.3763 10.4988 8.63893 9.93981 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 5.06731 8.0077 6.80232 17.2259 14.6646 9.29241 16.2901 14.5005 8.70479 4.21609 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 5.06731 8.0077 6.80232 17.2259 14.6646 9.29241 16.2901 14.5005 8.70479 4.21609 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 5.06731 8.0077 6.80232 17.2259 14.6646 9.29241 16.2901 14.5005 8.70479 4.21609 numMergedOcc 0
