0 mol 15 unq 0 iso 0 dist 8.0637 9.63035 8.9488 9.60736 5.61111 4.64441 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.58806 7.03345 12.5434 9.41386 5.45791 13.7907 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.58806 7.03345 12.5434 4.71964 9.19871 4.4386 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 8.58806 7.03345 12.5434 6.58478 7.47366 5.93497 numMergedOcc 0
4 mol 25 unq 3 iso 0 dist 8.58806 5.2296 9.57167 9.41386 5.45791 12.4749 numMergedOcc 0
5 mol 25 unq 4 iso 0 dist 8.58806 5.2296 9.57167 4.71964 9.19871 5.82028 numMergedOcc 0
6 mol 25 unq 5 iso 0 dist 8.58806 5.2296 9.57167 6.58478 7.47366 3.8794 numMergedOcc 0
7 mol 28 unq 0 iso 0 dist 6.53312 7.61643 8.84112 6.62508 7.77448 13.235 numMergedOcc 0
8 mol 28 unq 1 iso 0 dist 5.9948 8.85208 8.84112 9.77719 7.77448 13.235 numMergedOcc 0
9 mol 28 unq 2 iso 0 dist 5.9948 9.04974 4.31273 9.77719 7.77448 9.52915 numMergedOcc 0
10 mol 62 unq 0 iso 0 dist 4.85282 4.93315 5.02909 5.6359 5.46563 5.91118 numMergedOcc 0
11 mol 67 unq 0 iso 0 dist 5.77675 7.72671 5.66613 5.35145 3.77705 3.83735 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 7.7195 7.38306 14.8177 7.87612 13.0669 5.74689 numMergedOcc 0
13 mol 171 unq 1 iso 0 dist 9.43988 7.38306 4.63854 7.87612 5.89908 5.74689 numMergedOcc 0
14 mol 197 unq 0 iso 0 dist 8.05227 9.92707 12.2056 5.65314 10.9673 8.86998 numMergedOcc 0
15 mol 197 unq 1 iso 0 dist 8.05227 6.22734 10.3089 5.65314 10.9673 3.35829 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 9.60654 8.621 13.456 9.48525 16.0311 12.7959 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 7.11262 8.621 10.6299 9.48525 6.04066 12.7959 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 7.09902 6.25959 5.89828 7.79426 3.98113 4.74962 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 9.6748 9.87759 19.1894 7.42359 6.76489 16.6479 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 9.6748 6.0854 15.5949 7.42359 6.76489 13.1212 numMergedOcc 0
21 mol 243 unq 2 iso 0 dist 9.6748 7.86504 16.6342 7.42359 6.76489 13.3646 numMergedOcc 0
22 mol 243 unq 3 iso 0 dist 8.71177 9.87759 16.589 7.42359 3.72181 16.6479 numMergedOcc 0
23 mol 243 unq 4 iso 0 dist 8.71177 6.0854 13.8791 7.42359 3.72181 13.1212 numMergedOcc 0
24 mol 243 unq 5 iso 0 dist 8.71177 7.86504 12.5627 7.42359 3.72181 13.3646 numMergedOcc 0
25 mol 243 unq 6 iso 0 dist 6.5095 6.77411 5.58254 5.91328 6.75573 6.87269 numMergedOcc 0
26 mol 243 unq 7 iso 0 dist 6.5095 6.77411 5.58254 6.02146 7.64134 4.4421 numMergedOcc 0
27 mol 243 unq 8 iso 0 dist 5.1766 6.77411 10.2776 5.91328 8.61196 6.87269 numMergedOcc 0
28 mol 243 unq 9 iso 0 dist 5.1766 6.77411 10.2776 6.02146 10.4256 4.4421 numMergedOcc 0
29 mol 260 unq 0 iso 0 dist 4.76689 8.67835 9.87568 6.54521 6.73886 4.58993 numMergedOcc 0
30 mol 260 unq 1 iso 0 dist 7.26455 8.67835 9.94594 6.54521 5.38205 4.58993 numMergedOcc 0
31 mol 260 unq 2 iso 0 dist 8.79012 5.72892 12.3866 7.97307 9.0549 6.55333 numMergedOcc 0
32 mol 260 unq 3 iso 0 dist 8.79012 5.72892 12.3866 8.52702 17.1277 7.3298 numMergedOcc 0
33 mol 270 unq 0 iso 0 dist 4.60602 6.17797 9.50342 9.34963 12.8011 4.67018 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 6.84909 8.23483 12.3921 8.51266 11.4255 11.6449 numMergedOcc 0
