0 mol 4 unq 0 iso 0 dist 8.67981 7.97369 6.66589 9.6245 7.88748 4.90612 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 7.96306 11.1811 8.86547 8.3311 7.17698 6.37474 numMergedOcc 0
2 mol 38 unq 1 iso 0 dist 7.96306 11.1811 8.86547 5.96514 4.74069 6.10572 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.44077 5.16403 9.05728 4.89928 6.34215 9.49478 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.41952 5.85228 6.46655 10.4376 7.80026 6.08003 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 8.34804 11.9474 7.9572 3.77705 6.44825 9.25732 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 8.34804 16.4344 8.64208 3.77705 6.44825 13.625 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 5.73908 13.4703 9.7754 10.6719 8.52421 4.05832 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 8.39608 4.93292 8.21553 10.3685 7.50921 10.9021 numMergedOcc 0
9 mol 71 unq 1 iso 0 dist 8.39608 9.16746 8.22762 10.3685 7.50921 5.93189 numMergedOcc 0
10 mol 71 unq 2 iso 0 dist 7.28815 6.53623 8.21553 9.85206 7.50921 10.9021 numMergedOcc 0
11 mol 71 unq 3 iso 0 dist 7.28815 5.67157 8.22762 9.85206 7.50921 5.93189 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 8.09675 14.4838 9.89021 10.2047 7.69222 15.8457 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 8.09675 14.4838 9.89021 10.8441 5.82056 14.3818 numMergedOcc 0
14 mol 73 unq 2 iso 0 dist 8.09675 14.4838 9.89021 15.2203 9.09115 16.9684 numMergedOcc 0
15 mol 73 unq 3 iso 0 dist 9.02753 12.3838 9.89021 14.0199 7.69222 15.8457 numMergedOcc 0
16 mol 73 unq 4 iso 0 dist 9.02753 12.3838 9.89021 13.7625 5.82056 14.3818 numMergedOcc 0
17 mol 73 unq 5 iso 0 dist 9.02753 12.3838 9.89021 17.5374 9.09115 16.9684 numMergedOcc 0
18 mol 130 unq 0 iso 0 dist 9.92685 10.5415 9.05626 12.989 9.67398 4.97996 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 8.06614 5.27217 7.15203 10.7814 9.7105 6.9945 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 5.28423 5.01633 8.44823 5.27395 6.75471 9.85734 numMergedOcc 0
21 mol 155 unq 0 iso 0 dist 5.16143 5.01007 8.66709 5.05961 5.55218 7.10286 numMergedOcc 0
22 mol 155 unq 1 iso 0 dist 8.08392 12.7814 8.66709 5.68679 5.55218 7.10286 numMergedOcc 0
23 mol 168 unq 0 iso 0 dist 9.60268 6.51864 8.8573 5.4035 7.337 4.16504 numMergedOcc 0
24 mol 168 unq 1 iso 0 dist 8.79954 5.14137 8.8573 6.46155 7.337 4.16504 numMergedOcc 0
25 mol 171 unq 0 iso 0 dist 6.20851 9.22906 6.01711 9.12839 9.67711 7.5383 numMergedOcc 0
26 mol 173 unq 0 iso 0 dist 8.84813 6.91967 8.84671 5.21212 6.95244 7.73027 numMergedOcc 0
27 mol 173 unq 1 iso 0 dist 8.84813 6.91967 8.84671 11.2286 6.11224 8.97627 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 5.83898 9.40372 9.08672 10.2261 9.77333 7.31335 numMergedOcc 0
29 mol 217 unq 0 iso 0 dist 8.72578 6.20364 5.10683 3.59923 6.58871 4.64118 numMergedOcc 0
30 mol 219 unq 0 iso 0 dist 7.26376 5.0241 8.09769 8.72864 8.3704 11.3569 numMergedOcc 0
31 mol 219 unq 1 iso 0 dist 7.26376 4.36122 7.24832 8.72864 8.3704 4.78402 numMergedOcc 0
32 mol 220 unq 0 iso 0 dist 8.55805 15.5892 7.30244 5.06821 8.63649 14.9028 numMergedOcc 0
33 mol 220 unq 1 iso 0 dist 8.55805 15.0704 7.29796 5.06821 8.63649 14.1071 numMergedOcc 0
34 mol 258 unq 0 iso 0 dist 9.17911 9.07364 9.67877 11.5766 9.6327 6.95359 numMergedOcc 0
35 mol 258 unq 1 iso 0 dist 9.17911 17.1229 8.81059 11.5766 9.6327 13.987 numMergedOcc 0
36 mol 258 unq 2 iso 0 dist 9.17911 15.539 9.12006 11.5766 9.6327 15.8856 numMergedOcc 0
37 mol 258 unq 3 iso 0 dist 9.46746 9.05496 8.55181 9.21014 9.81589 10.9591 numMergedOcc 0
38 mol 258 unq 4 iso 0 dist 7.31698 6.46484 8.55181 4.58093 9.81589 10.9591 numMergedOcc 0
39 mol 258 unq 5 iso 0 dist 9.52903 14.2753 9.67877 11.7204 9.6327 6.95359 numMergedOcc 0
40 mol 258 unq 6 iso 0 dist 9.52903 7.52881 8.81059 11.7204 9.6327 13.987 numMergedOcc 0
41 mol 258 unq 7 iso 0 dist 9.52903 12.3042 9.12006 11.7204 9.6327 15.8856 numMergedOcc 0
42 mol 272 unq 0 iso 0 dist 7.38085 5.26991 8.82094 3.7218 5.38409 5.12237 numMergedOcc 0
43 mol 273 unq 0 iso 0 dist 9.80002 10.5063 6.54753 10.6534 8.66133 4.24707 numMergedOcc 0
44 mol 273 unq 1 iso 0 dist 9.80002 10.5063 6.54753 15.8245 6.95569 12.634 numMergedOcc 0
45 mol 273 unq 2 iso 0 dist 6.73794 5.75973 6.54753 3.80794 8.66133 4.24707 numMergedOcc 0
46 mol 273 unq 3 iso 0 dist 6.73794 5.75973 6.54753 13.255 6.95569 12.634 numMergedOcc 0
47 mol 277 unq 0 iso 0 dist 6.70414 14.2115 9.84188 12.2421 9.91103 19.0436 numMergedOcc 0
48 mol 277 unq 1 iso 0 dist 6.70414 14.2115 9.84188 10.9521 7.0603 15.7645 numMergedOcc 0
49 mol 277 unq 2 iso 0 dist 6.70414 10.8075 8.35794 12.2421 9.91103 17.6038 numMergedOcc 0
50 mol 277 unq 3 iso 0 dist 6.70414 10.8075 8.35794 10.9521 7.0603 14.772 numMergedOcc 0
51 mol 287 unq 0 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 numMergedOcc 0
52 mol 288 unq 0 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 numMergedOcc 0
53 mol 289 unq 0 iso 0 dist 7.47179 11.3154 7.13655 9.23896 6.06665 4.79186 numMergedOcc 0
