0 mol 6 unq 0 iso 0 dist 9.11819 6.69899 6.98764 6.92888 5.55524 7.88171 numMergedOcc 0
1 mol 13 unq 0 iso 0 dist 7.68531 8.54188 8.5226 5.27699 7.44816 6.94397 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 6.29578 10.352 8.45034 9.58891 9.4228 13.3556 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 4.82824 3.61874 7.70787 8.21111 5.62694 10.9651 numMergedOcc 0
4 mol 107 unq 0 iso 0 dist 7.06322 9.06016 8.83855 9.85159 7.02709 8.49615 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 5.6738 12.0115 9.43487 11.224 5.82487 11.0812 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 5.6738 13.077 9.97052 11.224 5.82487 8.67499 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 5.6738 12.0928 7.3324 11.224 5.82487 5.19652 numMergedOcc 0
8 mol 125 unq 0 iso 0 dist 7.7203 13.1097 9.87276 7.86775 6.72613 5.51248 numMergedOcc 0
9 mol 125 unq 1 iso 0 dist 7.7203 4.18521 9.97204 7.86775 6.72613 7.48533 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 8.43681 4.56096 5.94867 5.80401 5.50236 5.37365 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 5.99965 10.0631 9.33272 5.48717 9.83935 14.7094 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 9.64225 4.20889 9.34835 10.9291 9.28036 10.176 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 9.46363 10.534 9.05875 10.9346 7.06087 7.65735 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 9.72263 9.58042 8.15287 9.63443 7.68645 5.0241 numMergedOcc 0
15 mol 219 unq 1 iso 0 dist 9.72263 9.58042 8.15287 7.12445 5.75017 4.36122 numMergedOcc 0
16 mol 219 unq 2 iso 0 dist 9.72263 9.58042 8.15287 12.5322 6.12768 14.0703 numMergedOcc 0
17 mol 219 unq 3 iso 0 dist 9.72263 9.58042 8.15287 9.22518 7.19159 13.25 numMergedOcc 0
18 mol 219 unq 4 iso 0 dist 9.72263 12.8131 8.72341 9.63443 7.68645 14.1934 numMergedOcc 0
19 mol 219 unq 5 iso 0 dist 9.72263 12.8131 8.72341 7.12445 5.75017 13.288 numMergedOcc 0
20 mol 219 unq 6 iso 0 dist 9.72263 12.8131 8.72341 12.5322 6.12768 4.95329 numMergedOcc 0
21 mol 219 unq 7 iso 0 dist 9.72263 12.8131 8.72341 9.22518 7.19159 4.26247 numMergedOcc 0
22 mol 219 unq 8 iso 0 dist 9.65487 13.0508 8.15287 13.5278 7.68645 5.0241 numMergedOcc 0
23 mol 219 unq 9 iso 0 dist 9.65487 13.0508 8.15287 9.05006 5.75017 4.36122 numMergedOcc 0
24 mol 219 unq 10 iso 0 dist 9.65487 13.0508 8.15287 9.3707 6.12768 14.0703 numMergedOcc 0
25 mol 219 unq 11 iso 0 dist 9.65487 13.0508 8.15287 8.41263 7.19159 13.25 numMergedOcc 0
26 mol 219 unq 12 iso 0 dist 9.65487 10.1996 8.72341 13.5278 7.68645 14.1934 numMergedOcc 0
27 mol 219 unq 13 iso 0 dist 9.65487 10.1996 8.72341 9.05006 5.75017 13.288 numMergedOcc 0
28 mol 219 unq 14 iso 0 dist 9.65487 10.1996 8.72341 9.3707 6.12768 4.95329 numMergedOcc 0
29 mol 219 unq 15 iso 0 dist 9.65487 10.1996 8.72341 8.41263 7.19159 4.26247 numMergedOcc 0
30 mol 251 unq 0 iso 0 dist 9.31994 12.3736 6.32455 9.90201 9.207 12.3975 numMergedOcc 0
31 mol 251 unq 1 iso 0 dist 4.63025 6.87139 6.32455 5.60154 9.207 12.3975 numMergedOcc 0
32 mol 265 unq 0 iso 0 dist 6.52552 4.1118 6.46774 5.26386 8.2179 7.602 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 7.64453 9.99556 6.08044 16.3901 9.29241 9.67708 numMergedOcc 0
34 mol 287 unq 1 iso 0 dist 7.64453 7.32623 8.8956 16.3901 9.29241 15.5716 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 7.64453 9.99556 6.08044 16.3901 9.29241 9.67708 numMergedOcc 0
36 mol 288 unq 1 iso 0 dist 7.64453 7.32623 8.8956 16.3901 9.29241 15.5716 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 7.64453 9.99556 6.08044 16.3901 9.29241 9.67708 numMergedOcc 0
38 mol 289 unq 1 iso 0 dist 7.64453 7.32623 8.8956 16.3901 9.29241 15.5716 numMergedOcc 0
