0 mol 18 unq 0 iso 0 dist 9.74802 5.79003 8.09187 9.8269 8.70343 9.1397 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.70934 3.24351 5.9972 8.88829 7.93694 8.91596 numMergedOcc 0
2 mol 36 unq 0 iso 0 dist 7.20197 4.09734 7.23219 10.8075 7.87445 8.41542 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 8.55666 8.60758 5.45882 14.9207 8.69934 8.99912 numMergedOcc 0
4 mol 113 unq 1 iso 0 dist 8.45284 5.85846 5.45882 14.1773 8.69934 8.99912 numMergedOcc 0
5 mol 113 unq 2 iso 0 dist 7.77845 10.3632 5.45882 9.80191 8.69934 8.99912 numMergedOcc 0
6 mol 113 unq 3 iso 0 dist 9.43828 14.0625 5.45882 17.1947 8.69934 8.99912 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 7.83743 11.2581 9.26486 13.845 9.2907 9.93438 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 8.97156 8.34668 7.79077 10.5533 4.77464 5.39356 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 8.97156 8.34668 7.79077 11.3531 7.11695 5.01504 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 8.97156 8.34668 7.79077 14.6556 9.79266 6.80627 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.82363 10.39 6.40751 11.5041 7.57216 7.46621 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 5.76702 8.89934 6.40751 11.6996 7.57216 7.46621 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 7.88785 5.76262 9.23589 9.11046 6.02355 6.73617 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 7.88785 4.09924 9.22196 9.11046 6.02355 9.03544 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 9.47487 15.4113 9.77656 7.18765 5.2908 9.23086 numMergedOcc 0
16 mol 197 unq 1 iso 0 dist 9.47487 15.4113 9.77656 13.1253 10.5397 8.37086 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 9.99897 5.6513 7.77225 12.4367 4.62998 9.18744 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 9.99897 9.53574 5.50067 14.6115 7.23534 5.30118 numMergedOcc 0
19 mol 287 unq 2 iso 0 dist 9.99897 9.53574 5.50067 18.5016 11.7115 8.98698 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 9.99897 5.6513 7.77225 12.4367 4.62998 9.18744 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 9.99897 9.53574 5.50067 14.6115 7.23534 5.30118 numMergedOcc 0
22 mol 288 unq 2 iso 0 dist 9.99897 9.53574 5.50067 18.5016 11.7115 8.98698 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.99897 5.6513 7.77225 12.4367 4.62998 9.18744 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 9.99897 9.53574 5.50067 14.6115 7.23534 5.30118 numMergedOcc 0
25 mol 289 unq 2 iso 0 dist 9.99897 9.53574 5.50067 18.5016 11.7115 8.98698 numMergedOcc 0
