0 mol 1 unq 0 iso 0 dist 7.68779 6.24156 12.7243 11.6758 17.3552 9.84681 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 7.0928 6.04822 5.03027 8.22296 13.353 9.10473 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 7.0928 7.72717 8.17061 8.22296 13.353 9.20827 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.16827 5.19462 5.07458 5.15224 12.5807 8.03914 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.16827 5.19462 5.07458 8.07402 12.2944 9.04174 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 9.31319 9.72136 13.1434 9.89704 17.5682 8.16183 numMergedOcc 0
6 mol 46 unq 1 iso 0 dist 8.2513 9.72136 14.5035 9.89704 15.6381 8.16183 numMergedOcc 0
7 mol 70 unq 0 iso 0 dist 7.95122 8.55467 8.70781 6.73368 11.7089 5.80074 numMergedOcc 0
8 mol 70 unq 1 iso 0 dist 9.74268 8.55467 13.4238 6.73368 15.3547 5.80074 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 5.02591 8.06358 6.9648 8.98055 10.1256 5.85873 numMergedOcc 0
10 mol 86 unq 0 iso 0 dist 5.49793 7.19148 5.9022 7.90563 10.4544 6.56673 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 5.89394 8.3435 4.46885 5.73112 4.98104 8.67475 numMergedOcc 0
12 mol 110 unq 0 iso 0 dist 6.59361 8.27843 8.4494 6.82715 5.25492 9.24252 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 8.62898 6.02506 9.29878 9.7362 16.2731 9.93912 numMergedOcc 0
14 mol 148 unq 1 iso 0 dist 8.62898 6.02506 9.29878 6.33907 14.0476 8.3656 numMergedOcc 0
15 mol 148 unq 2 iso 0 dist 9.7168 9.8506 15.239 17.0927 24.6331 9.93912 numMergedOcc 0
16 mol 148 unq 3 iso 0 dist 9.7168 9.8506 15.239 7.50382 16.4612 8.3656 numMergedOcc 0
17 mol 148 unq 4 iso 0 dist 7.38138 9.8506 8.68046 17.0927 17.4999 9.93912 numMergedOcc 0
18 mol 148 unq 5 iso 0 dist 7.38138 9.8506 8.68046 7.50382 10.69 8.3656 numMergedOcc 0
19 mol 150 unq 0 iso 0 dist 8.6102 6.07854 9.35505 6.43607 14.1199 8.44633 numMergedOcc 0
20 mol 150 unq 1 iso 0 dist 9.61132 9.91991 15.2388 7.48524 16.3796 8.44633 numMergedOcc 0
21 mol 150 unq 2 iso 0 dist 7.34423 9.91991 8.55576 7.48524 10.6513 8.44633 numMergedOcc 0
22 mol 182 unq 0 iso 0 dist 6.31492 8.45614 4.88992 9.76376 10.7505 7.21988 numMergedOcc 0
23 mol 182 unq 1 iso 0 dist 6.31492 8.45614 4.88992 10.8611 11.0828 8.14376 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 8.3035 8.9694 8.48942 9.59563 13.2093 5.79617 numMergedOcc 0
25 mol 217 unq 0 iso 0 dist 8.28941 5.01648 4.64118 5.24737 9.22235 8.46235 numMergedOcc 0
26 mol 217 unq 1 iso 0 dist 8.28941 5.01648 4.64118 5.51329 9.91098 5.27487 numMergedOcc 0
27 mol 218 unq 0 iso 0 dist 8.74123 6.112 6.28653 10.7067 14.3061 8.38813 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 9.29203 9.97859 16.7443 16.9796 21.1599 8.28643 numMergedOcc 0
29 mol 238 unq 1 iso 0 dist 7.62771 9.97859 13.1408 16.9796 16.8553 8.28643 numMergedOcc 0
30 mol 238 unq 2 iso 0 dist 7.80166 9.97859 10.4706 16.9796 16.0821 8.28643 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 9.22576 7.74312 4.13216 5.44878 12.0651 9.94851 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 9.22576 7.74312 4.13216 5.44878 12.0651 9.94851 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 9.22576 7.74312 4.13216 5.44878 12.0651 9.94851 numMergedOcc 0
