0 mol 20 unq 0 iso 0 dist 9.55415 7.17695 4.8515 6.21227 9.70606 6.09002 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 9.18109 7.36836 15.1968 5.66535 6.87871 9.99939 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.69443 4.90216 12.2061 10.9658 19.4255 8.30217 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 6.02034 8.48827 13.1307 7.17843 11.0964 7.91148 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 6.02034 7.14048 10.7383 7.17843 11.0964 6.59794 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 6.77808 8.03895 13.1307 4.4651 11.0964 7.91148 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 6.77808 5.68873 10.7383 4.4651 11.0964 6.59794 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 9.79844 6.3323 5.26527 11.1132 11.5807 7.44558 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 6.81489 6.01857 5.11935 11.1675 10.5232 7.42146 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 8.63018 7.84813 6.14663 5.56946 6.29026 7.97548 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 8.63018 7.84813 6.14663 6.4379 10.5241 9.9291 numMergedOcc 0
11 mol 129 unq 2 iso 0 dist 8.63018 7.84813 6.14663 6.10584 11.4199 7.32151 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 6.85651 4.82356 3.75786 4.84607 8.84018 5.78814 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 9.21256 8.22722 11.2135 17.2785 20.5343 9.72387 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 6.23615 8.52036 11.2135 16.4238 20.5343 9.72387 numMergedOcc 0
15 mol 133 unq 3 iso 0 dist 7.03858 8.83476 3.75786 11.981 8.84018 5.78814 numMergedOcc 0
16 mol 136 unq 0 iso 0 dist 9.87222 9.73897 9.72078 6.38418 11.1969 9.92504 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 6.00651 8.76449 6.99467 6.91778 9.18866 6.73617 numMergedOcc 0
18 mol 147 unq 1 iso 0 dist 6.00651 8.36182 4.53687 6.91778 9.18866 9.03544 numMergedOcc 0
19 mol 147 unq 2 iso 0 dist 8.52428 8.76449 10.4515 6.91778 12.9055 6.73617 numMergedOcc 0
20 mol 147 unq 3 iso 0 dist 8.52428 8.36182 9.02691 6.91778 12.9055 9.03544 numMergedOcc 0
21 mol 154 unq 0 iso 0 dist 7.31277 8.26128 4.8443 5.88662 10.7167 8.89394 numMergedOcc 0
22 mol 162 unq 0 iso 0 dist 9.51731 9.067 3.57652 6.46702 9.82249 7.93088 numMergedOcc 0
23 mol 180 unq 0 iso 0 dist 5.43774 7.58661 6.15473 6.54937 8.44989 9.63576 numMergedOcc 0
24 mol 180 unq 1 iso 0 dist 8.31061 5.81023 6.15473 6.91082 8.44989 9.63576 numMergedOcc 0
25 mol 183 unq 0 iso 0 dist 9.86506 9.61725 16.7354 9.95614 19.7973 9.96536 numMergedOcc 0
26 mol 183 unq 1 iso 0 dist 5.83335 7.16035 9.54202 10.0008 15.6552 9.96536 numMergedOcc 0
27 mol 183 unq 2 iso 0 dist 7.86724 9.61725 9.54202 9.95614 15.6552 9.96536 numMergedOcc 0
28 mol 183 unq 3 iso 0 dist 9.92635 7.16035 10.7786 10.0008 7.31181 9.96536 numMergedOcc 0
29 mol 183 unq 4 iso 0 dist 7.85507 9.61725 10.7786 9.95614 7.31181 9.96536 numMergedOcc 0
30 mol 213 unq 0 iso 0 dist 5.01229 7.49754 5.36904 7.78293 9.94786 8.82761 numMergedOcc 0
31 mol 213 unq 1 iso 0 dist 5.01229 7.49754 5.36904 4.67262 4.58599 4.66576 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 6.11539 8.54126 3.79439 5.70808 8.68464 8.60731 numMergedOcc 0
33 mol 232 unq 1 iso 0 dist 9.71082 7.64079 3.79439 4.86949 8.68464 8.60731 numMergedOcc 0
34 mol 237 unq 0 iso 0 dist 8.37331 7.69237 6.50729 10.902 14.88 9.7255 numMergedOcc 0
35 mol 258 unq 0 iso 0 dist 6.18894 6.61322 10.613 9.07364 14.5083 8.03012 numMergedOcc 0
36 mol 283 unq 0 iso 0 dist 7.90132 9.35302 7.27864 4.44211 9.53225 9.07995 numMergedOcc 0
37 mol 294 unq 0 iso 0 dist 5.27236 7.48987 4.99494 5.57606 6.47832 7.56669 numMergedOcc 0
