0 mol 34 unq 0 iso 0 dist 9.69215 6.73754 5.98267 14.0782 14.0576 9.44189 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 9.77392 10.316 9.10516 11.6912 5.3502 8.08117 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.46302 6.99094 7.59119 11.9217 6.61767 5.75761 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.43699 10.8087 7.66662 11.1604 4.79817 6.33741 numMergedOcc 0
4 mol 74 unq 1 iso 0 dist 5.23115 11.4327 7.66662 9.99155 4.79817 6.33741 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 8.87924 6.53925 7.65996 14.2965 9.14315 9.30559 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 8.87924 6.53925 7.65996 6.35462 7.48682 5.96359 numMergedOcc 0
7 mol 88 unq 2 iso 0 dist 8.87924 6.53925 7.65996 10.7802 7.54949 7.48974 numMergedOcc 0
8 mol 88 unq 3 iso 0 dist 8.87924 6.53925 7.65996 13.6768 11.2245 8.40428 numMergedOcc 0
9 mol 88 unq 4 iso 0 dist 8.87924 4.95463 6.92784 7.74197 5.31226 6.066 numMergedOcc 0
10 mol 88 unq 5 iso 0 dist 8.87924 4.95463 6.92784 7.86537 9.61103 9.36032 numMergedOcc 0
11 mol 88 unq 6 iso 0 dist 8.87924 4.95463 6.92784 6.35462 7.48682 8.3592 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.1835 5.4578 7.05969 6.18763 5.75886 9.70093 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.1835 5.4578 7.05969 5.63005 6.4739 6.69217 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 7.34386 4.48767 6.08509 10.0854 9.74107 6.05583 numMergedOcc 0
15 mol 140 unq 0 iso 0 dist 7.85653 5.35142 5.30663 9.6224 5.11372 9.46004 numMergedOcc 0
16 mol 140 unq 1 iso 0 dist 7.5639 5.35142 8.50156 9.6224 4.46582 9.46004 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 9.12296 6.35499 9.58615 12.4261 12.5754 6.95549 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 9.91705 3.96762 9.2826 12.06 9.92777 8.47008 numMergedOcc 0
19 mol 181 unq 1 iso 0 dist 7.92476 10.501 9.2826 10.5756 9.92777 8.47008 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 5.22349 4.59117 7.19006 6.1197 6.66384 6.68262 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 8.28871 5.63694 6.74637 7.36905 4.48907 8.29556 numMergedOcc 0
22 mol 264 unq 1 iso 0 dist 8.28871 5.63694 6.74637 9.43335 9.09085 8.47755 numMergedOcc 0
23 mol 264 unq 2 iso 0 dist 7.94668 11.6787 6.74637 11.1873 4.48907 8.29556 numMergedOcc 0
24 mol 264 unq 3 iso 0 dist 7.94668 11.6787 6.74637 16.8768 9.09085 8.47755 numMergedOcc 0
