0 mol 25 unq 0 iso 0 dist 7.72372 5.78908 7.03372 9.10175 9.34154 7.6114 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.70331 14.036 8.91596 12.7837 6.37026 7.26268 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 4.8983 4.30874 7.37171 5.82056 10.0644 5.5087 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 4.8983 4.30874 7.37171 9.09115 12.1501 6.08682 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 4.8983 6.97502 8.62079 12.6865 14.0236 8.72682 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 4.8983 6.97502 8.62079 7.69222 11.9118 6.45841 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 4.8983 6.97502 8.62079 5.82056 10.0644 5.61588 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 4.8983 6.97502 8.62079 9.09115 12.1501 7.83244 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 9.93747 9.1771 8.34957 14.6918 10.6388 6.85523 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 9.93747 9.1771 8.34957 10.8124 3.81575 5.77326 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 6.34669 5.60777 4.17838 12.0302 7.35325 7.13008 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 9.57769 10.9135 9.30832 16.4147 10.4701 8.80934 numMergedOcc 0
12 mol 122 unq 0 iso 0 dist 4.821 6.28781 4.42563 7.97194 3.17342 6.00603 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 4.4077 4.80675 7.97548 8.85652 9.87781 5.51197 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 4.4077 4.80675 7.97548 9.31543 9.74071 6.69691 numMergedOcc 0
15 mol 129 unq 2 iso 0 dist 4.4077 4.80675 7.97548 12.172 13.8096 8.86944 numMergedOcc 0
16 mol 129 unq 3 iso 0 dist 8.4874 4.80675 9.64164 8.85652 9.93375 5.51197 numMergedOcc 0
17 mol 129 unq 4 iso 0 dist 8.4874 4.80675 9.64164 9.31543 6.92699 6.69691 numMergedOcc 0
18 mol 129 unq 5 iso 0 dist 8.4874 4.80675 9.64164 12.172 11.221 8.86944 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 9.57243 12.8338 7.46621 16.2296 8.53163 8.07097 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 9.99012 17.4764 8.64905 17.1946 10.4448 5.37047 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 5.33772 5.11989 8.64905 9.33882 10.4448 5.37047 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 6.68265 6.62991 7.55934 9.17216 5.12696 6.59889 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 6.68265 6.62991 7.55934 9.44172 6.04238 8.9192 numMergedOcc 0
24 mol 152 unq 2 iso 0 dist 7.78842 7.17016 7.55934 9.40483 5.12696 6.59889 numMergedOcc 0
25 mol 152 unq 3 iso 0 dist 7.78842 7.17016 7.55934 12.3659 6.04238 8.9192 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 4.79423 8.24478 5.90765 6.49577 3.60793 8.73533 numMergedOcc 0
27 mol 205 unq 0 iso 0 dist 8.83628 14.3203 9.31158 10.2097 6.49396 6.49765 numMergedOcc 0
28 mol 251 unq 0 iso 0 dist 8.15014 7.54315 8.45764 11.3617 5.79539 7.39775 numMergedOcc 0
29 mol 251 unq 1 iso 0 dist 8.15014 7.54315 8.45764 8.07576 3.45567 6.50357 numMergedOcc 0
30 mol 251 unq 2 iso 0 dist 6.06154 6.33949 8.45764 5.62261 5.79539 7.39775 numMergedOcc 0
31 mol 251 unq 3 iso 0 dist 6.06154 6.33949 8.45764 6.17824 3.45567 6.50357 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 4.1545 10.4297 7.42932 9.91103 5.9732 5.46926 numMergedOcc 0
33 mol 277 unq 1 iso 0 dist 4.1545 10.4297 7.42932 7.0603 3.79766 5.13913 numMergedOcc 0
34 mol 277 unq 2 iso 0 dist 4.1545 5.77904 4.9764 13.222 13.2853 9.35539 numMergedOcc 0
35 mol 277 unq 3 iso 0 dist 4.1545 5.77904 4.9764 9.91103 5.9732 8.9682 numMergedOcc 0
36 mol 277 unq 4 iso 0 dist 4.1545 5.77904 4.9764 7.0603 3.79766 6.92711 numMergedOcc 0
37 mol 277 unq 5 iso 0 dist 4.25172 5.77904 6.36559 13.222 12.4985 9.35539 numMergedOcc 0
38 mol 277 unq 6 iso 0 dist 4.25172 5.77904 6.36559 9.91103 8.61922 8.9682 numMergedOcc 0
39 mol 277 unq 7 iso 0 dist 4.25172 5.77904 6.36559 7.0603 7.07613 6.92711 numMergedOcc 0
40 mol 285 unq 0 iso 0 dist 6.07843 5.93692 6.71946 13.1783 10.2856 7.80862 numMergedOcc 0
41 mol 285 unq 1 iso 0 dist 7.08681 9.237 5.03601 6.24134 4.98469 7.80862 numMergedOcc 0
42 mol 285 unq 2 iso 0 dist 9.66678 5.93692 5.03601 13.1783 4.98469 7.80862 numMergedOcc 0
43 mol 292 unq 0 iso 0 dist 9.25289 8.15589 9.96374 10.6439 3.08474 9.46442 numMergedOcc 0
44 mol 292 unq 1 iso 0 dist 9.25289 8.15589 9.96374 10.9096 6.12546 7.30758 numMergedOcc 0
45 mol 292 unq 2 iso 0 dist 9.25289 8.15589 9.96374 15.7865 12.0714 9.5785 numMergedOcc 0
46 mol 292 unq 3 iso 0 dist 9.25289 8.15589 9.96374 13.3584 12.7236 9.76319 numMergedOcc 0
47 mol 292 unq 4 iso 0 dist 9.29687 15.908 9.96374 12.3587 3.08474 9.46442 numMergedOcc 0
48 mol 292 unq 5 iso 0 dist 9.29687 15.908 9.96374 15.129 6.12546 7.30758 numMergedOcc 0
49 mol 292 unq 6 iso 0 dist 9.29687 15.908 9.96374 17.134 12.0714 9.5785 numMergedOcc 0
50 mol 292 unq 7 iso 0 dist 9.29687 15.908 9.96374 14.0612 12.7236 9.76319 numMergedOcc 0
