0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 10.3034 10.9812 6.3267 11.8368 11.5748 6.78129 5.75315 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.23213 10.4498 10.3034 14.3013 6.3267 11.8368 15.9415 6.78129 5.75315 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 8.27962 6.85412 9.29529 5.8245 5.84314 3.91075 9.71516 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 8.47421 5.60154 11.4878 6.33889 7.2199 5.8245 5.84314 3.91075 9.81658 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 6.43774 7.06308 4.71384 9.01651 12.1257 8.59109 13.6385 16.2085 11.9463 5.81001 numMergedOcc 0
5 mol 45 unq 1 iso 0 dist 7.2846 6.34173 4.71384 6.89191 12.1257 8.59109 12.457 16.2085 11.9463 5.81001 numMergedOcc 0
6 mol 45 unq 2 iso 0 dist 7.58835 6.34173 5.67689 6.89191 9.20119 8.59109 12.457 12.466 11.9463 5.81001 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 7.32874 6.40841 6.75888 4.55117 8.26899 8.80108 9.97819 6.20618 10.7257 7.60018 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 7.32874 6.40841 6.75888 4.55117 8.26899 8.80108 8.69057 5.61579 11.0945 7.03126 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 6.64012 7.58407 5.11205 14.7581 13.7148 8.80108 18.2125 14.6101 10.7257 7.60018 numMergedOcc 0
10 mol 58 unq 3 iso 0 dist 6.64012 7.58407 5.11205 14.7581 13.7148 8.80108 18.0198 15.561 11.0945 7.03126 numMergedOcc 0
11 mol 58 unq 4 iso 0 dist 9.4099 6.31428 5.11205 10.3782 13.7148 8.80108 14.4477 14.6101 10.7257 7.60018 numMergedOcc 0
12 mol 58 unq 5 iso 0 dist 9.4099 6.31428 5.11205 10.3782 13.7148 8.80108 13.1897 15.561 11.0945 7.03126 numMergedOcc 0
13 mol 58 unq 6 iso 0 dist 9.55426 6.31428 6.75888 10.3782 8.26899 8.80108 14.4477 6.20618 10.7257 7.60018 numMergedOcc 0
14 mol 58 unq 7 iso 0 dist 9.55426 6.31428 6.75888 10.3782 8.26899 8.80108 13.1897 5.61579 11.0945 7.03126 numMergedOcc 0
15 mol 72 unq 0 iso 0 dist 8.8178 6.77912 12.0644 9.0131 13.3133 9.19459 7.12321 4.27726 9.88768 9.14817 numMergedOcc 0
16 mol 72 unq 1 iso 0 dist 8.8178 6.77912 12.0644 9.0131 13.3133 9.19459 9.35457 5.93202 12.9007 9.76686 numMergedOcc 0
17 mol 72 unq 2 iso 0 dist 8.8178 6.77912 12.0644 9.0131 13.3133 9.19459 12.1131 8.7566 12.9235 9.437 numMergedOcc 0
18 mol 72 unq 3 iso 0 dist 9.96708 6.77912 7.11552 9.0131 7.321 9.19459 7.12321 7.47371 9.88768 9.14817 numMergedOcc 0
19 mol 72 unq 4 iso 0 dist 9.96708 6.77912 7.11552 9.0131 7.321 9.19459 9.35457 9.67587 12.9007 9.76686 numMergedOcc 0
20 mol 72 unq 5 iso 0 dist 9.96708 6.77912 7.11552 9.0131 7.321 9.19459 12.1131 7.07356 12.9235 9.437 numMergedOcc 0
21 mol 72 unq 6 iso 0 dist 9.96708 7.321 9.0131 7.11552 6.77912 9.19459 10.7102 10.0679 5.11318 9.37102 numMergedOcc 0
22 mol 72 unq 7 iso 0 dist 9.96708 7.321 9.0131 7.11552 6.77912 9.19459 9.55118 5.69391 6.74416 5.4605 numMergedOcc 0
23 mol 72 unq 8 iso 0 dist 9.96708 7.321 9.0131 7.11552 6.77912 9.19459 12.111 4.03844 10.7904 6.53824 numMergedOcc 0
24 mol 72 unq 9 iso 0 dist 9.96708 7.321 9.0131 7.17489 10.4676 8.59747 10.7102 10.0679 5.11318 7.93683 numMergedOcc 0
25 mol 72 unq 10 iso 0 dist 9.96708 7.321 9.0131 7.17489 10.4676 8.59747 9.55118 5.69391 6.74416 6.7272 numMergedOcc 0
26 mol 72 unq 11 iso 0 dist 9.96708 7.321 9.0131 7.17489 10.4676 8.59747 9.10345 13.4212 5.63793 7.64009 numMergedOcc 0
27 mol 72 unq 12 iso 0 dist 9.78528 7.321 6.11922 7.11552 11.9814 9.19459 10.7102 10.1392 5.11318 9.37102 numMergedOcc 0
28 mol 72 unq 13 iso 0 dist 9.78528 7.321 6.11922 7.11552 11.9814 9.19459 9.55118 9.78221 6.74416 5.4605 numMergedOcc 0
29 mol 72 unq 14 iso 0 dist 9.78528 7.321 6.11922 7.11552 11.9814 9.19459 12.111 11.5881 10.7904 6.53824 numMergedOcc 0
30 mol 72 unq 15 iso 0 dist 9.78528 7.321 6.11922 7.17489 13.3943 8.59747 10.7102 10.1392 5.11318 7.93683 numMergedOcc 0
31 mol 72 unq 16 iso 0 dist 9.78528 7.321 6.11922 7.17489 13.3943 8.59747 9.55118 9.78221 6.74416 6.7272 numMergedOcc 0
32 mol 72 unq 17 iso 0 dist 9.78528 7.321 6.11922 7.17489 13.3943 8.59747 9.10345 11.6634 5.63793 7.64009 numMergedOcc 0
33 mol 88 unq 0 iso 0 dist 9.36773 8.66514 8.4283 5.90098 9.15979 7.71582 10.2942 9.08023 6.67934 5.28732 numMergedOcc 0
34 mol 88 unq 1 iso 0 dist 9.36773 9.25235 5.37521 5.90098 9.15979 6.65776 10.2942 9.08023 4.39545 5.28732 numMergedOcc 0
35 mol 115 unq 0 iso 0 dist 9.33865 7.64585 10.2377 10.7942 7.76729 6.40036 6.39384 6.63111 5.65471 8.0168 numMergedOcc 0
36 mol 115 unq 1 iso 0 dist 9.33865 7.76729 10.7942 10.2377 7.64585 6.40036 6.24825 6.95773 5.78043 7.65255 numMergedOcc 0
37 mol 115 unq 2 iso 0 dist 5.83991 7.76729 10.9739 10.2377 12.2309 6.40036 6.24825 6.01673 5.78043 7.65255 numMergedOcc 0
38 mol 115 unq 3 iso 0 dist 6.11741 7.64585 10.8939 10.7942 12.9821 6.40036 6.39384 6.07067 5.65471 8.0168 numMergedOcc 0
39 mol 155 unq 0 iso 0 dist 6.23493 9.86313 5.86939 13.5062 12.1081 7.37901 12.9034 9.16779 4.48516 5.36254 numMergedOcc 0
40 mol 155 unq 1 iso 0 dist 7.46303 7.51198 5.86939 8.27726 12.1081 7.37901 8.97626 9.16779 4.48516 5.36254 numMergedOcc 0
41 mol 155 unq 2 iso 0 dist 6.43582 7.51198 6.34186 8.27726 7.36102 7.37901 8.97626 4.91785 4.48516 5.36254 numMergedOcc 0
42 mol 175 unq 0 iso 0 dist 9.0018 9.8589 8.22779 11.0415 9.31887 4.79852 13.6764 5.00913 9.433 9.76114 numMergedOcc 0
43 mol 175 unq 1 iso 0 dist 7.652 7.24908 8.22779 5.0384 9.31887 4.79852 10.1305 5.00913 9.433 9.76114 numMergedOcc 0
44 mol 175 unq 2 iso 0 dist 5.6234 9.8589 10.5631 11.0415 12.816 4.79852 13.6764 11.1374 9.433 9.76114 numMergedOcc 0
45 mol 175 unq 3 iso 0 dist 9.92231 7.24908 10.5631 5.0384 12.816 4.79852 10.1305 11.1374 9.433 9.76114 numMergedOcc 0
46 mol 175 unq 4 iso 0 dist 6.57069 9.8589 7.5414 11.0415 11.3137 4.79852 13.6764 11.9979 9.433 9.76114 numMergedOcc 0
47 mol 234 unq 0 iso 0 dist 9.45496 9.5707 15.9563 5.56749 15.004 8.49841 7.81215 12.4252 11.8229 9.11572 numMergedOcc 0
48 mol 234 unq 1 iso 0 dist 9.45496 9.5707 15.9563 12.1076 17.6567 9.6101 7.81215 12.4252 11.8229 7.20293 numMergedOcc 0
49 mol 234 unq 2 iso 0 dist 6.7625 9.5707 14.4106 5.56749 10.8628 8.49841 7.81215 5.75498 11.8229 9.11572 numMergedOcc 0
50 mol 234 unq 3 iso 0 dist 6.7625 9.5707 14.4106 12.1076 12.6312 9.6101 7.81215 5.75498 11.8229 7.20293 numMergedOcc 0
51 mol 234 unq 4 iso 0 dist 8.41436 6.16063 11.3297 5.9221 13.651 8.49841 8.84746 16.268 6.00588 8.27411 numMergedOcc 0
52 mol 234 unq 5 iso 0 dist 8.41436 6.16063 11.3297 5.9221 13.651 8.49841 11.1846 16.6139 14.8966 6.96257 numMergedOcc 0
53 mol 234 unq 6 iso 0 dist 8.92474 6.16063 10.2563 5.9221 10.521 8.49841 8.84746 15.0244 6.00588 8.27411 numMergedOcc 0
54 mol 234 unq 7 iso 0 dist 8.92474 6.16063 10.2563 5.9221 10.521 8.49841 11.1846 12.0765 14.8966 6.96257 numMergedOcc 0
55 mol 238 unq 0 iso 0 dist 6.22714 7.49471 5.17471 12.1252 9.38422 6.17025 8.69015 10.3162 6.12722 9.84652 numMergedOcc 0
56 mol 238 unq 1 iso 0 dist 7.31233 7.02475 11.2717 8.82861 9.38422 6.65088 9.12776 10.3162 13.037 9.84652 numMergedOcc 0
57 mol 238 unq 2 iso 0 dist 7.31233 7.67322 12.6986 8.82861 9.38422 6.5772 9.12776 10.3162 9.75095 9.84652 numMergedOcc 0
58 mol 238 unq 3 iso 0 dist 7.31233 7.19008 5.17471 8.82861 9.38422 6.17025 9.12776 10.3162 6.12722 9.84652 numMergedOcc 0
59 mol 272 unq 0 iso 0 dist 8.48753 7.67853 6.64985 5.7074 10.597 6.75716 11.5372 9.74916 9.96809 9.19905 numMergedOcc 0
