0 mol 35 unq 0 iso 0 dist 5.55901 11.0391 9.03313 9.466 4.08654 9.8985 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.52295 9.8284 5.0553 18.1208 10.871 9.05728 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.59983 5.00567 8.02624 8.04256 13.8724 6.87176 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 6.59983 5.00567 8.02624 12.2463 13.5622 7.45675 numMergedOcc 0
4 mol 68 unq 2 iso 0 dist 9.92579 5.00567 9.63119 8.04256 15.9935 6.87176 numMergedOcc 0
5 mol 68 unq 3 iso 0 dist 9.92579 5.00567 9.63119 12.2463 12.8986 7.45675 numMergedOcc 0
6 mol 68 unq 4 iso 0 dist 9.12636 9.84174 8.02624 11.2365 13.8724 6.87176 numMergedOcc 0
7 mol 68 unq 5 iso 0 dist 9.12636 9.84174 8.02624 14.5917 13.5622 7.45675 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 9.739 5.00649 7.85668 9.23023 5.40759 9.99029 numMergedOcc 0
9 mol 127 unq 0 iso 0 dist 9.91321 5.88232 7.34368 10.0998 6.3084 6.65963 numMergedOcc 0
10 mol 127 unq 1 iso 0 dist 9.91321 5.88232 7.34368 9.42513 12.4721 8.62711 numMergedOcc 0
11 mol 132 unq 0 iso 0 dist 8.31873 7.68244 9.11314 11.8382 13.8574 6.495 numMergedOcc 0
12 mol 132 unq 1 iso 0 dist 8.31873 7.68244 9.11314 14.3811 14.5559 9.43748 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.06801 8.90456 5.35463 16.6939 10.5856 8.44823 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 9.19804 13.7645 8.9675 17.9801 9.20471 9.04554 numMergedOcc 0
15 mol 162 unq 0 iso 0 dist 8.99034 12.2516 7.80955 9.97921 5.05715 9.89142 numMergedOcc 0
16 mol 162 unq 1 iso 0 dist 8.99034 12.2516 7.80955 12.6002 5.65753 8.06091 numMergedOcc 0
17 mol 162 unq 2 iso 0 dist 8.99034 5.55488 6.66396 12.6002 5.65753 8.15223 numMergedOcc 0
18 mol 167 unq 0 iso 0 dist 6.00793 5.30254 7.78684 5.59806 6.38496 7.83781 numMergedOcc 0
19 mol 174 unq 0 iso 0 dist 8.99695 7.31124 4.97597 15.6701 8.48462 8.4931 numMergedOcc 0
20 mol 180 unq 0 iso 0 dist 9.99096 7.68826 8.16047 10.218 6.26263 7.08676 numMergedOcc 0
21 mol 206 unq 0 iso 0 dist 6.38964 5.59897 5.99766 9.78438 6.13816 7.0119 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 8.74988 6.28086 7.5725 11.3536 10.3804 8.33847 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 6.21022 9.91968 9.05568 9.772 12.0749 7.54805 numMergedOcc 0
24 mol 265 unq 1 iso 0 dist 8.06252 8.39994 9.05568 11.5176 12.0749 7.54805 numMergedOcc 0
