0 mol 5 unq 0 iso 0 dist 6.66949 11.5151 6.86923 4.05341 5.69239 10.7591 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.66949 12.4484 9.95226 4.05341 5.69239 10.9809 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 6.66949 4.25268 4.60775 4.05341 5.69239 3.91535 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 6.66949 10.2365 8.64744 4.05341 5.69239 6.94674 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 5.11382 4.71974 7.61183 11.1055 8.25818 14.3151 numMergedOcc 0
5 mol 28 unq 0 iso 0 dist 8.06843 11.8666 8.92334 5.44908 9.74532 9.71507 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 7.10496 4.16338 4.62145 6.55665 6.87277 3.90342 numMergedOcc 0
7 mol 33 unq 0 iso 0 dist 4.41045 6.76474 7.97002 3.82411 4.78873 3.63113 numMergedOcc 0
8 mol 46 unq 0 iso 0 dist 5.81662 10.2011 7.44805 3.8412 3.77542 6.81182 numMergedOcc 0
9 mol 46 unq 1 iso 0 dist 5.81662 10.2011 7.44805 6.17831 9.97314 16.1056 numMergedOcc 0
10 mol 48 unq 0 iso 0 dist 9.07283 5.0573 7.90416 5.7037 9.05737 9.165 numMergedOcc 0
11 mol 62 unq 0 iso 0 dist 6.51901 9.59858 7.01397 4.29679 4.46067 7.90686 numMergedOcc 0
12 mol 62 unq 1 iso 0 dist 9.1926 15.1484 7.01397 8.07308 4.46067 7.90686 numMergedOcc 0
13 mol 63 unq 0 iso 0 dist 9.56838 5.60513 6.42443 11.1855 9.13228 12.6017 numMergedOcc 0
14 mol 85 unq 0 iso 0 dist 6.56288 4.77114 8.67342 7.14242 6.67137 4.8069 numMergedOcc 0
15 mol 85 unq 1 iso 0 dist 6.56288 4.77114 8.67342 15.2173 9.78707 18.1303 numMergedOcc 0
16 mol 85 unq 2 iso 0 dist 6.56288 4.4924 5.73739 7.14242 6.67137 10.0178 numMergedOcc 0
17 mol 85 unq 3 iso 0 dist 6.56288 4.4924 5.73739 15.2173 9.78707 12.1664 numMergedOcc 0
18 mol 85 unq 4 iso 0 dist 5.97559 4.77114 8.60062 9.52671 7.07839 11.1042 numMergedOcc 0
19 mol 85 unq 5 iso 0 dist 5.97559 4.77114 8.60062 8.62855 7.91193 10.9585 numMergedOcc 0
20 mol 85 unq 6 iso 0 dist 5.97559 4.77114 8.60062 5.86553 9.09711 7.55572 numMergedOcc 0
21 mol 85 unq 7 iso 0 dist 5.97559 4.77114 8.60062 7.14242 7.04244 4.8069 numMergedOcc 0
22 mol 85 unq 8 iso 0 dist 5.97559 4.77114 8.60062 15.2173 9.63449 18.1303 numMergedOcc 0
23 mol 85 unq 9 iso 0 dist 5.97559 4.4924 5.16225 9.52671 7.07839 10.0529 numMergedOcc 0
24 mol 85 unq 10 iso 0 dist 5.97559 4.4924 5.16225 5.86553 9.09711 8.41797 numMergedOcc 0
25 mol 85 unq 11 iso 0 dist 5.97559 4.4924 5.16225 8.62855 7.91193 9.0874 numMergedOcc 0
26 mol 85 unq 12 iso 0 dist 5.97559 4.4924 5.16225 7.14242 7.04244 10.0178 numMergedOcc 0
27 mol 85 unq 13 iso 0 dist 5.97559 4.4924 5.16225 15.2173 9.63449 12.1664 numMergedOcc 0
28 mol 85 unq 14 iso 0 dist 9.27814 16.1344 8.00314 11.9486 4.18248 4.21164 numMergedOcc 0
29 mol 147 unq 0 iso 0 dist 5.39386 7.12442 6.42361 3.75216 3.82583 3.7035 numMergedOcc 0
30 mol 147 unq 1 iso 0 dist 5.39386 7.12442 6.42361 6.64419 8.25768 3.20279 numMergedOcc 0
31 mol 147 unq 2 iso 0 dist 5.79819 7.12442 7.4121 3.75216 5.19116 3.7035 numMergedOcc 0
32 mol 147 unq 3 iso 0 dist 5.79819 7.12442 7.4121 6.64419 8.71702 3.20279 numMergedOcc 0
33 mol 213 unq 0 iso 0 dist 5.90026 4.99303 8.22178 5.16198 7.93317 3.89477 numMergedOcc 0
34 mol 213 unq 1 iso 0 dist 8.86496 11.4794 8.22178 10.4575 7.93317 3.89477 numMergedOcc 0
35 mol 266 unq 0 iso 0 dist 5.28746 4.79328 7.74133 9.23405 6.96692 13.3554 numMergedOcc 0
36 mol 266 unq 1 iso 0 dist 5.28746 4.79328 7.74133 11.313 8.25286 15.2892 numMergedOcc 0
37 mol 266 unq 2 iso 0 dist 5.28746 4.79328 7.74133 13.005 9.9965 16.6916 numMergedOcc 0
38 mol 266 unq 3 iso 0 dist 7.43884 4.90161 5.36518 11.4637 7.80711 10.1418 numMergedOcc 0
39 mol 266 unq 4 iso 0 dist 7.43884 4.90161 5.36518 12.3524 9.9965 7.63149 numMergedOcc 0
40 mol 266 unq 5 iso 0 dist 7.43884 9.17114 9.11585 11.4637 7.80711 10.3155 numMergedOcc 0
41 mol 266 unq 6 iso 0 dist 7.43884 9.17114 9.11585 12.3524 9.9965 4.39553 numMergedOcc 0
42 mol 281 unq 0 iso 0 dist 9.05453 9.69803 9.39268 16.2801 7.90368 12.4082 numMergedOcc 0
43 mol 281 unq 1 iso 0 dist 9.05453 9.69803 9.39268 9.81081 6.69267 10.4439 numMergedOcc 0
44 mol 281 unq 2 iso 0 dist 9.05453 10.9252 9.06888 16.2801 7.90368 15.8562 numMergedOcc 0
45 mol 281 unq 3 iso 0 dist 9.05453 10.9252 9.06888 9.81081 6.69267 6.28551 numMergedOcc 0
46 mol 287 unq 0 iso 0 dist 8.4625 11.9132 5.55176 11.4589 4.68668 5.13698 numMergedOcc 0
47 mol 288 unq 0 iso 0 dist 8.4625 11.9132 5.55176 11.4589 4.68668 5.13698 numMergedOcc 0
48 mol 289 unq 0 iso 0 dist 8.4625 11.9132 5.55176 11.4589 4.68668 5.13698 numMergedOcc 0
