0 mol 19 unq 0 iso 0 dist 8.40416 6.74265 7.02548 13.287 6.60936 8.19695 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.75618 5.5841 7.02548 10.3056 6.60936 8.19695 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 6.41575 5.14627 5.82366 14.129 10.4685 9.85134 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 6.41423 4.69858 5.82366 13.212 10.4685 9.85134 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 9.52474 7.50515 7.60283 15.1462 9.51391 8.71752 numMergedOcc 0
5 mol 41 unq 0 iso 0 dist 8.51663 5.0364 6.42834 11.6539 10.1421 6.73801 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.37007 9.97281 7.1539 9.71168 6.34272 5.39745 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 6.95572 6.99832 5.39745 10.5753 6.34272 7.1539 numMergedOcc 0
8 mol 126 unq 0 iso 0 dist 6.30546 7.01257 7.36017 10.0699 6.71205 5.14819 numMergedOcc 0
9 mol 126 unq 1 iso 0 dist 6.30546 7.01257 7.36017 12.8712 10.7821 6.84245 numMergedOcc 0
10 mol 126 unq 2 iso 0 dist 6.29233 5.15767 5.14819 11.4486 6.71205 7.36017 numMergedOcc 0
11 mol 126 unq 3 iso 0 dist 6.29233 5.15767 5.14819 5.42406 4.32209 6.84245 numMergedOcc 0
12 mol 126 unq 4 iso 0 dist 5.42406 5.15767 6.84245 11.4486 10.7821 7.36017 numMergedOcc 0
13 mol 126 unq 5 iso 0 dist 5.42406 5.15767 6.84245 6.29233 4.32209 5.14819 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 9.72053 6.01663 6.90634 12.2057 12.1655 9.62236 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 7.7949 12.8559 6.90634 19.7642 12.1655 9.62236 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.22232 12.0863 8.21165 12.817 4.40317 7.41399 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 9.22232 12.0863 8.21165 13.416 10.8204 8.97945 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 9.22232 12.0863 8.21165 17.1879 16.3424 9.50664 numMergedOcc 0
19 mol 133 unq 3 iso 0 dist 9.22232 12.0863 8.21165 16.1663 12.3323 6.71555 numMergedOcc 0
20 mol 133 unq 4 iso 0 dist 9.22661 4.68409 6.51868 7.56378 7.33253 7.34698 numMergedOcc 0
21 mol 133 unq 5 iso 0 dist 7.56378 4.68409 7.34698 9.22661 7.33253 6.51868 numMergedOcc 0
22 mol 141 unq 0 iso 0 dist 8.10291 10.5489 4.25566 12.5586 6.33946 7.31037 numMergedOcc 0
23 mol 141 unq 1 iso 0 dist 9.87644 4.29204 8.00449 11.9341 4.27704 8.75562 numMergedOcc 0
24 mol 146 unq 0 iso 0 dist 8.84535 14.7359 9.44952 13.867 5.54669 6.50043 numMergedOcc 0
25 mol 146 unq 1 iso 0 dist 8.82188 7.00857 9.44952 10.0609 5.54669 6.50043 numMergedOcc 0
26 mol 148 unq 0 iso 0 dist 9.91993 10.2478 8.73468 6.22055 4.32771 9.73927 numMergedOcc 0
27 mol 148 unq 1 iso 0 dist 9.99156 6.84291 8.73468 8.18085 4.32771 9.73927 numMergedOcc 0
28 mol 148 unq 2 iso 0 dist 6.22055 10.2478 9.73927 9.91993 4.32771 8.73468 numMergedOcc 0
29 mol 148 unq 3 iso 0 dist 8.18085 6.84291 9.73927 9.99156 4.32771 8.73468 numMergedOcc 0
30 mol 150 unq 0 iso 0 dist 9.96691 10.2318 8.73558 6.14675 4.39943 9.66129 numMergedOcc 0
31 mol 150 unq 1 iso 0 dist 9.8656 6.79619 8.73558 7.94889 4.39943 9.66129 numMergedOcc 0
32 mol 150 unq 2 iso 0 dist 6.14675 10.2318 9.66129 9.96691 4.39943 8.73558 numMergedOcc 0
33 mol 150 unq 3 iso 0 dist 7.94889 6.79619 9.66129 9.8656 4.39943 8.73558 numMergedOcc 0
34 mol 155 unq 0 iso 0 dist 7.92304 6.34186 9.80845 10.3161 6.56063 7.55196 numMergedOcc 0
35 mol 155 unq 1 iso 0 dist 8.69157 8.78665 7.55196 14.7195 6.56063 9.80845 numMergedOcc 0
36 mol 155 unq 2 iso 0 dist 6.53347 5.40375 7.55196 11.1616 6.56063 9.80845 numMergedOcc 0
37 mol 159 unq 0 iso 0 dist 9.17787 6.49376 6.72852 8.4858 7.73341 8.52082 numMergedOcc 0
38 mol 159 unq 1 iso 0 dist 8.4858 6.49376 8.52082 9.17787 7.73341 6.72852 numMergedOcc 0
39 mol 175 unq 0 iso 0 dist 9.77896 7.5414 5.4997 14.2813 6.75531 6.99693 numMergedOcc 0
40 mol 224 unq 0 iso 0 dist 9.51597 7.67202 8.08737 11.6901 4.48107 9.22384 numMergedOcc 0
41 mol 234 unq 0 iso 0 dist 7.32499 13.2297 7.94068 13.2078 9.00021 7.22019 numMergedOcc 0
42 mol 237 unq 0 iso 0 dist 7.41478 6.56344 5.98039 10.985 5.62416 9.48932 numMergedOcc 0
43 mol 237 unq 1 iso 0 dist 9.16003 13.7089 9.27395 11.4712 6.08027 7.55103 numMergedOcc 0
44 mol 237 unq 2 iso 0 dist 6.99315 10.1861 7.55103 11.598 6.08027 9.27395 numMergedOcc 0
45 mol 237 unq 3 iso 0 dist 9.60163 9.10323 7.55103 12.4388 6.08027 9.27395 numMergedOcc 0
46 mol 238 unq 0 iso 0 dist 7.57812 5.11565 8.90076 8.69104 6.25098 6.62002 numMergedOcc 0
47 mol 238 unq 1 iso 0 dist 7.57812 13.0842 6.87131 10.784 4.34277 8.81629 numMergedOcc 0
48 mol 238 unq 2 iso 0 dist 7.57812 13.0842 6.87131 8.69104 6.25098 9.69818 numMergedOcc 0
49 mol 238 unq 3 iso 0 dist 7.57812 13.171 8.09718 8.69104 6.25098 6.73446 numMergedOcc 0
50 mol 238 unq 4 iso 0 dist 9.24557 11.0401 8.90076 12.9364 6.25098 6.62002 numMergedOcc 0
51 mol 238 unq 5 iso 0 dist 9.24557 8.85181 6.87131 12.6066 4.34277 8.81629 numMergedOcc 0
52 mol 238 unq 6 iso 0 dist 9.24557 8.85181 6.87131 12.9364 6.25098 9.69818 numMergedOcc 0
53 mol 238 unq 7 iso 0 dist 9.24557 11.9142 8.09718 12.9364 6.25098 6.73446 numMergedOcc 0
54 mol 238 unq 8 iso 0 dist 8.69104 5.11565 6.62002 7.57812 6.25098 8.90076 numMergedOcc 0
55 mol 238 unq 9 iso 0 dist 8.69104 13.0842 9.69818 10.784 8.96242 8.81629 numMergedOcc 0
56 mol 238 unq 10 iso 0 dist 8.69104 13.0842 9.69818 7.57812 6.25098 6.87131 numMergedOcc 0
57 mol 238 unq 11 iso 0 dist 8.69104 13.171 6.73446 7.57812 6.25098 8.09718 numMergedOcc 0
