0 mol 6 unq 0 iso 0 dist 8.15992 14.4522 9.07564 13.3289 6.94663 9.5447 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 4.82562 7.33688 9.07564 6.8041 6.94663 9.5447 numMergedOcc 0
2 mol 6 unq 2 iso 0 dist 8.85796 13.7747 9.07564 15.1488 6.94663 9.5447 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 9.74528 11.3059 9.89425 12.8782 6.76736 6.859 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 5.65754 5.61248 7.7447 8.3964 9.63925 5.80953 numMergedOcc 0
5 mol 29 unq 0 iso 0 dist 6.80828 5.45544 5.99655 13.9571 9.01071 9.41017 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 5.26566 9.4465 8.71074 16.6085 16.2325 7.98985 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 4.8983 5.75925 4.27766 8.13535 4.1846 5.7684 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 6.65972 11.5374 9.04293 9.21479 5.84075 9.77084 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 6.65972 5.21981 4.78333 9.21479 5.84075 6.5551 numMergedOcc 0
10 mol 79 unq 2 iso 0 dist 4.2253 5.21981 4.74254 9.21479 5.41884 6.5551 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 8.66427 12.4236 5.37869 15.0808 7.66499 5.05893 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 8.66427 9.61831 4.05415 15.0808 7.66499 5.71866 numMergedOcc 0
13 mol 85 unq 2 iso 0 dist 7.51319 8.08787 4.29937 9.18097 5.22259 5.05893 numMergedOcc 0
14 mol 85 unq 3 iso 0 dist 7.51319 10.4844 3.65628 9.18097 5.22259 5.71866 numMergedOcc 0
15 mol 85 unq 4 iso 0 dist 8.49887 8.08787 5.37869 9.18097 7.66499 5.05893 numMergedOcc 0
16 mol 85 unq 5 iso 0 dist 8.49887 10.4844 4.05415 9.18097 7.66499 5.71866 numMergedOcc 0
17 mol 85 unq 6 iso 0 dist 9.43839 11.053 4.29937 8.83135 5.22259 5.05893 numMergedOcc 0
18 mol 85 unq 7 iso 0 dist 9.43839 7.97629 3.65628 8.83135 5.22259 5.71866 numMergedOcc 0
19 mol 91 unq 0 iso 0 dist 8.91998 5.09341 7.71625 6.93893 12.8723 8.77355 numMergedOcc 0
20 mol 93 unq 0 iso 0 dist 8.55758 5.84807 6.67678 7.13064 5.64998 9.19977 numMergedOcc 0
21 mol 93 unq 1 iso 0 dist 8.55758 5.84807 6.67678 7.8962 4.34681 7.28831 numMergedOcc 0
22 mol 93 unq 2 iso 0 dist 8.55758 5.84807 6.67678 10.092 9.11796 9.71411 numMergedOcc 0
23 mol 93 unq 3 iso 0 dist 7.44027 5.84807 7.24956 7.13064 4.76749 9.19977 numMergedOcc 0
24 mol 93 unq 4 iso 0 dist 7.44027 5.84807 7.24956 7.8962 5.73248 7.28831 numMergedOcc 0
25 mol 93 unq 5 iso 0 dist 7.44027 5.84807 7.24956 10.092 7.24672 9.71411 numMergedOcc 0
26 mol 107 unq 0 iso 0 dist 7.2168 13.076 6.49371 13.4265 8.49625 5.33764 numMergedOcc 0
27 mol 141 unq 0 iso 0 dist 8.12558 4.62155 5.95801 8.46376 10.3222 7.58337 numMergedOcc 0
28 mol 194 unq 0 iso 0 dist 7.56217 5.39223 4.45769 5.4455 3.7326 4.19371 numMergedOcc 0
29 mol 194 unq 1 iso 0 dist 7.56217 7.15294 8.99961 5.4455 3.7326 9.71015 numMergedOcc 0
30 mol 194 unq 2 iso 0 dist 9.81055 5.39223 5.89939 5.4455 7.29209 4.19371 numMergedOcc 0
31 mol 194 unq 3 iso 0 dist 9.81055 7.15294 8.18853 5.4455 7.29209 9.71015 numMergedOcc 0
32 mol 214 unq 0 iso 0 dist 9.53899 10.0389 7.66702 13.8459 7.23583 5.44533 numMergedOcc 0
33 mol 224 unq 0 iso 0 dist 6.06793 6.97024 7.99036 11.2825 13.1055 7.30592 numMergedOcc 0
34 mol 224 unq 1 iso 0 dist 6.06793 6.97024 7.99036 8.99978 8.81276 9.46687 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 9.09279 15.5357 9.81261 10.4743 3.99887 8.09509 numMergedOcc 0
36 mol 260 unq 0 iso 0 dist 6.90472 13.8859 7.49606 10.4828 7.28821 9.31888 numMergedOcc 0
37 mol 292 unq 0 iso 0 dist 9.25289 14.8716 9.21469 12.9862 4.30125 8.6233 numMergedOcc 0
38 mol 292 unq 1 iso 0 dist 9.29687 14.3247 9.21469 8.67838 4.30125 8.6233 numMergedOcc 0
