0 mol 5 unq 0 iso 0 dist 8.62847 6.66949 3.14155 4.05341 7.56229 5.69239 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.83589 8.7443 5.70796 6.3338 9.53277 10.5354 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.77987 7.63824 7.63404 6.50899 8.31631 13.1926 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 5.84349 4.41045 3.60218 3.82411 4.64187 4.78873 numMergedOcc 0
4 mol 33 unq 1 iso 0 dist 5.84349 4.41045 3.60218 4.28598 7.95437 8.03913 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 6.887 7.68019 3.41186 5.29955 6.52283 4.75881 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 8.09973 6.58981 3.73834 3.66673 7.16844 4.46067 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 8.53833 9.56838 10.1907 11.1855 8.78414 9.13228 numMergedOcc 0
8 mol 63 unq 1 iso 0 dist 9.6401 5.89846 4.73277 6.63195 8.78414 8.14512 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.25047 8.63792 3.35924 8.58059 5.45099 7.66068 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.25047 8.63792 3.35924 14.7497 8.44765 9.5043 numMergedOcc 0
11 mol 76 unq 2 iso 0 dist 8.25047 8.63792 3.35924 14.3572 9.06643 8.34132 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.24296 8.15861 3.65186 3.81285 4.29937 6.67137 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 6.24296 8.15861 3.65186 6.17121 5.37869 7.04244 numMergedOcc 0
14 mol 85 unq 2 iso 0 dist 6.24296 9.27814 14.6387 3.81285 4.29937 12.9252 numMergedOcc 0
15 mol 85 unq 3 iso 0 dist 6.24296 9.27814 14.6387 6.17121 5.37869 15.2807 numMergedOcc 0
16 mol 85 unq 4 iso 0 dist 6.83218 8.15861 7.00044 3.81285 3.65628 6.67137 numMergedOcc 0
17 mol 85 unq 5 iso 0 dist 6.83218 8.15861 7.00044 6.17121 4.05415 7.04244 numMergedOcc 0
18 mol 85 unq 6 iso 0 dist 6.83218 9.27814 15.2529 3.81285 3.65628 12.9252 numMergedOcc 0
19 mol 85 unq 7 iso 0 dist 6.83218 9.27814 15.2529 6.17121 4.05415 15.2807 numMergedOcc 0
20 mol 91 unq 0 iso 0 dist 6.64714 7.09177 9.60912 9.46631 7.71625 14.8326 numMergedOcc 0
21 mol 93 unq 0 iso 0 dist 9.43355 8.61597 13.6138 13.6305 6.67678 17.7956 numMergedOcc 0
22 mol 93 unq 1 iso 0 dist 9.43355 8.61597 13.6138 14.1431 7.24956 16.8842 numMergedOcc 0
23 mol 93 unq 2 iso 0 dist 9.43355 8.61597 13.6138 3.99275 8.28591 11.5475 numMergedOcc 0
24 mol 93 unq 3 iso 0 dist 9.43355 8.61597 13.6138 6.46195 9.40687 9.66837 numMergedOcc 0
25 mol 93 unq 4 iso 0 dist 5.64141 8.61597 12.3588 3.99275 5.35008 11.5475 numMergedOcc 0
26 mol 93 unq 5 iso 0 dist 5.64141 8.61597 12.3588 6.46195 8.84576 9.66837 numMergedOcc 0
27 mol 93 unq 6 iso 0 dist 5.46186 8.61597 4.98621 3.99275 8.30921 11.5475 numMergedOcc 0
28 mol 93 unq 7 iso 0 dist 5.46186 8.61597 4.98621 6.46195 7.39732 9.66837 numMergedOcc 0
29 mol 93 unq 8 iso 0 dist 5.46186 8.61597 4.98621 10.4525 9.67744 12.6171 numMergedOcc 0
30 mol 116 unq 0 iso 0 dist 5.93365 6.98134 3.43966 4.26914 7.54274 6.55227 numMergedOcc 0
31 mol 116 unq 1 iso 0 dist 6.99944 7.65919 6.48852 9.53399 7.54274 13.0017 numMergedOcc 0
32 mol 116 unq 2 iso 0 dist 6.99944 8.55413 3.43966 9.53399 7.54274 6.55227 numMergedOcc 0
33 mol 123 unq 0 iso 0 dist 6.49766 8.09682 8.42496 3.61945 4.14492 5.56127 numMergedOcc 0
34 mol 123 unq 1 iso 0 dist 6.49766 8.35926 10.3919 3.61945 4.14492 8.03692 numMergedOcc 0
35 mol 123 unq 2 iso 0 dist 6.49766 7.41568 3.3389 3.61945 4.14492 5.36214 numMergedOcc 0
36 mol 147 unq 0 iso 0 dist 8.10157 5.39386 3.7729 3.75216 5.12272 3.82583 numMergedOcc 0
37 mol 147 unq 1 iso 0 dist 8.10157 5.39386 3.7729 6.64419 8.7121 8.25768 numMergedOcc 0
38 mol 147 unq 2 iso 0 dist 8.10157 5.79819 6.34165 3.75216 5.12272 5.19116 numMergedOcc 0
39 mol 147 unq 3 iso 0 dist 8.10157 5.79819 6.34165 6.64419 8.7121 8.71702 numMergedOcc 0
40 mol 147 unq 4 iso 0 dist 8.10157 6.03024 10.7999 3.75216 5.12272 8.45156 numMergedOcc 0
41 mol 147 unq 5 iso 0 dist 8.10157 6.03024 10.7999 6.64419 8.7121 11.7923 numMergedOcc 0
42 mol 186 unq 0 iso 0 dist 8.28282 6.91764 3.11607 12.5023 9.34653 11.9419 numMergedOcc 0
43 mol 218 unq 0 iso 0 dist 5.4767 6.46335 5.42052 6.58822 6.17843 10.8886 numMergedOcc 0
44 mol 218 unq 1 iso 0 dist 5.4767 6.46335 5.42052 9.62149 8.52772 12.4557 numMergedOcc 0
45 mol 243 unq 0 iso 0 dist 7.13476 7.39884 7.66826 5.38511 9.53137 4.55853 numMergedOcc 0
46 mol 287 unq 0 iso 0 dist 9.98518 8.15636 16.9188 3.76412 8.06767 10.5724 numMergedOcc 0
47 mol 287 unq 1 iso 0 dist 9.98518 7.86292 12.935 3.76412 8.06767 9.98932 numMergedOcc 0
48 mol 287 unq 2 iso 0 dist 7.51385 6.05363 7.98095 6.00938 6.22311 10.5724 numMergedOcc 0
49 mol 288 unq 0 iso 0 dist 9.98518 8.15636 16.9188 3.76412 8.06767 10.5724 numMergedOcc 0
50 mol 288 unq 1 iso 0 dist 9.98518 7.86292 12.935 3.76412 8.06767 9.98932 numMergedOcc 0
51 mol 288 unq 2 iso 0 dist 7.51385 6.05363 7.98095 6.00938 6.22311 10.5724 numMergedOcc 0
52 mol 289 unq 0 iso 0 dist 9.98518 8.15636 16.9188 3.76412 8.06767 10.5724 numMergedOcc 0
53 mol 289 unq 1 iso 0 dist 9.98518 7.86292 12.935 3.76412 8.06767 9.98932 numMergedOcc 0
54 mol 289 unq 2 iso 0 dist 7.51385 6.05363 7.98095 6.00938 6.22311 10.5724 numMergedOcc 0
