0 mol 0 unq 0 iso 0 dist 9.94618 9.16606 11.4815 5.98788 7.06591 13.0422 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 8.23852 5.39008 4.46089 6.10734 6.996 5.12621 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 7.12013 9.46895 8.79217 6.19304 8.43877 12.7517 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.58709 7.67459 8.75469 8.74005 5.3991 8.59948 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.10175 6.29755 12.1689 9.57335 11.14 9.58891 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 6.10175 6.29755 12.1689 8.60653 7.93241 11.1253 numMergedOcc 0
6 mol 54 unq 2 iso 0 dist 6.10175 7.4038 11.8364 9.57335 11.14 7.573 numMergedOcc 0
7 mol 54 unq 3 iso 0 dist 6.10175 7.4038 11.8364 8.60653 7.93241 10.063 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 8.06263 5.48997 6.94076 8.87151 6.99666 9.58376 numMergedOcc 0
9 mol 71 unq 0 iso 0 dist 4.87423 7.12853 5.01302 8.72533 10.1334 6.64442 numMergedOcc 0
10 mol 71 unq 1 iso 0 dist 4.76283 6.14513 5.01302 9.14345 10.1334 6.64442 numMergedOcc 0
11 mol 71 unq 2 iso 0 dist 4.76283 7.4392 4.64256 9.14345 10.1334 11.496 numMergedOcc 0
12 mol 71 unq 3 iso 0 dist 7.75237 7.12853 9.08204 8.72533 8.8528 6.64442 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 8.87856 7.88143 6.62867 6.04768 11.3708 12.9271 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 8.87856 6.62952 11.2334 6.04768 11.3708 12.2431 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 6.2491 7.88143 12.7928 6.04768 7.43547 12.9271 numMergedOcc 0
16 mol 98 unq 3 iso 0 dist 6.2491 6.62952 7.89992 6.04768 7.43547 12.2431 numMergedOcc 0
17 mol 98 unq 4 iso 0 dist 3.59451 4.3521 7.89992 9.40173 7.43547 12.2431 numMergedOcc 0
18 mol 125 unq 0 iso 0 dist 8.15971 8.44933 5.16445 8.2793 10.5488 6.58625 numMergedOcc 0
19 mol 125 unq 1 iso 0 dist 8.15971 7.43803 5.32986 8.2793 10.5488 6.67445 numMergedOcc 0
20 mol 156 unq 0 iso 0 dist 6.47989 5.50879 4.68339 8.32841 5.46268 5.6621 numMergedOcc 0
21 mol 156 unq 1 iso 0 dist 6.47989 5.50879 4.68339 6.00295 4.78734 6.65278 numMergedOcc 0
22 mol 184 unq 0 iso 0 dist 5.13722 8.49577 8.78766 6.65725 8.44389 8.87236 numMergedOcc 0
23 mol 193 unq 0 iso 0 dist 5.19654 8.71993 3.53549 6.28889 7.03947 9.08423 numMergedOcc 0
24 mol 203 unq 0 iso 0 dist 8.8589 7.72215 9.33982 8.83947 8.50137 6.40721 numMergedOcc 0
25 mol 203 unq 1 iso 0 dist 8.8589 5.46529 4.9404 8.83947 8.50137 4.76871 numMergedOcc 0
26 mol 210 unq 0 iso 0 dist 7.68078 8.94889 12.3142 8.78652 11.256 4.36112 numMergedOcc 0
27 mol 210 unq 1 iso 0 dist 7.68078 8.94889 12.3142 9.01437 12.6561 10.7545 numMergedOcc 0
28 mol 210 unq 2 iso 0 dist 9.26518 8.94889 13.7365 8.78652 11.3555 4.36112 numMergedOcc 0
29 mol 210 unq 3 iso 0 dist 9.26518 8.94889 13.7365 9.01437 4.94588 10.7545 numMergedOcc 0
30 mol 220 unq 0 iso 0 dist 4.3362 6.89587 5.7733 9.75868 11.317 9.58883 numMergedOcc 0
31 mol 220 unq 1 iso 0 dist 5.51565 6.89587 4.4922 9.75868 5.72178 9.58883 numMergedOcc 0
32 mol 226 unq 0 iso 0 dist 9.05082 8.24741 12.3913 6.82883 7.93097 4.66376 numMergedOcc 0
33 mol 226 unq 1 iso 0 dist 9.05082 8.24741 12.3913 6.95495 4.87605 13.3747 numMergedOcc 0
34 mol 255 unq 0 iso 0 dist 6.61193 7.16286 6.41518 9.96678 8.21757 5.92336 numMergedOcc 0
35 mol 256 unq 0 iso 0 dist 8.11884 9.92947 10.2154 9.31961 6.82173 9.96775 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 9.36052 7.84151 10.402 8.16005 5.527 11.4694 numMergedOcc 0
37 mol 273 unq 1 iso 0 dist 9.36052 7.85797 5.78379 8.16005 5.527 4.73332 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 8.83777 6.40125 6.08499 7.88238 12.5151 11.8 numMergedOcc 0
39 mol 277 unq 1 iso 0 dist 9.42812 6.40125 10.3278 7.88238 5.10104 11.8 numMergedOcc 0
40 mol 279 unq 0 iso 0 dist 8.18179 7.14122 10.2078 7.61501 14.2071 6.2981 numMergedOcc 0
41 mol 279 unq 1 iso 0 dist 7.45556 7.14122 4.8005 7.61501 4.45759 6.2981 numMergedOcc 0
42 mol 279 unq 2 iso 0 dist 5.25218 7.14122 8.61009 7.61501 5.65772 6.2981 numMergedOcc 0
43 mol 280 unq 0 iso 0 dist 9.047 6.38295 14.0927 9.55885 4.6462 12.6793 numMergedOcc 0
44 mol 280 unq 1 iso 0 dist 9.9227 6.38295 11.4101 9.55885 12.0238 12.6793 numMergedOcc 0
