0 mol 43 unq 0 iso 0 dist 8.38387 9.52295 6.09486 11.8286 6.20293 9.07906 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.38387 9.52295 6.09486 12.381 12.2321 8.75567 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 7.74197 6.64933 11.9839 4.0486 9.36773 9.54952 numMergedOcc 0
3 mol 88 unq 1 iso 0 dist 7.86537 6.64933 10.6664 4.0486 8.31336 9.54952 numMergedOcc 0
4 mol 88 unq 2 iso 0 dist 6.35462 6.64933 4.79268 4.0486 10.3436 9.54952 numMergedOcc 0
5 mol 110 unq 0 iso 0 dist 8.181 4.78944 3.99091 3.94206 10.4494 6.60331 numMergedOcc 0
6 mol 110 unq 1 iso 0 dist 8.181 4.78944 3.99091 7.58348 12.6366 9.22311 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.82535 6.29634 7.64945 12.1192 15.3394 8.20715 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.82535 6.29634 7.64945 5.3154 9.80193 6.16081 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 6.18763 6.29634 7.36889 12.1192 13.9919 8.20715 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 6.18763 6.29634 7.36889 5.3154 6.18601 6.16081 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 8.44385 6.29634 4.55137 12.1192 9.87172 8.20715 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 8.44385 6.29634 4.55137 5.3154 10.1813 6.16081 numMergedOcc 0
13 mol 119 unq 6 iso 0 dist 5.63005 6.29634 6.42493 12.1192 12.6489 8.20715 numMergedOcc 0
14 mol 119 unq 7 iso 0 dist 5.63005 6.29634 6.42493 5.3154 9.72413 6.16081 numMergedOcc 0
15 mol 127 unq 0 iso 0 dist 9.42513 9.91321 12.4721 8.60326 9.30299 8.82676 numMergedOcc 0
16 mol 127 unq 1 iso 0 dist 9.42513 9.91321 12.4721 11.4002 14.9565 8.17522 numMergedOcc 0
17 mol 127 unq 2 iso 0 dist 9.42513 9.91321 12.4721 11.7596 18.1486 8.14341 numMergedOcc 0
18 mol 127 unq 3 iso 0 dist 9.42513 9.91321 12.4721 7.698 13.3014 6.54744 numMergedOcc 0
19 mol 132 unq 0 iso 0 dist 8.7366 5.25894 6.6218 4.90475 7.7059 5.36351 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 9.50322 6.31523 10.7358 4.64588 12.6651 8.75049 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 5.82404 6.31523 5.58281 4.64588 6.80239 8.75049 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 8.07256 9.06801 5.97115 11.1874 6.70283 8.86966 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 8.07256 9.06801 5.97115 8.36099 7.16148 5.7527 numMergedOcc 0
24 mol 157 unq 0 iso 0 dist 6.1835 6.09357 3.8758 3.99423 9.25027 7.52643 numMergedOcc 0
25 mol 162 unq 0 iso 0 dist 9.97921 8.99034 5.05715 6.00067 11.4903 9.48488 numMergedOcc 0
26 mol 167 unq 0 iso 0 dist 5.59806 6.00793 6.38496 9.57777 12.4733 6.85239 numMergedOcc 0
27 mol 167 unq 1 iso 0 dist 5.59806 6.00793 6.38496 8.66436 9.87651 5.72735 numMergedOcc 0
28 mol 185 unq 0 iso 0 dist 9.878 6.70069 7.73092 4.53126 14.0188 8.78799 numMergedOcc 0
29 mol 185 unq 1 iso 0 dist 9.21149 9.52532 7.73092 9.27932 14.0188 8.78799 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 8.96988 9.33272 5.88779 14.7094 14.4482 9.83935 numMergedOcc 0
31 mol 206 unq 0 iso 0 dist 9.78438 6.38964 6.13816 5.70669 12.5958 7.03546 numMergedOcc 0
32 mol 206 unq 1 iso 0 dist 9.78438 6.38964 6.13816 10.3584 13.4144 9.62822 numMergedOcc 0
33 mol 249 unq 0 iso 0 dist 6.37672 5.68936 5.40456 4.24014 6.18582 7.27415 numMergedOcc 0
34 mol 251 unq 0 iso 0 dist 9.228 6.32455 8.56132 12.3975 13.3555 9.207 numMergedOcc 0
35 mol 251 unq 1 iso 0 dist 7.4878 6.32455 7.703 12.3975 16.0401 9.207 numMergedOcc 0
