0 mol 5 unq 0 iso 0 dist 9.22067 14.5394 8.49537 11.9525 6.14476 4.66108 numMergedOcc 0
1 mol 5 unq 0 iso 1 dist 8.49537 14.5394 9.22067 4.66108 6.14476 11.9525 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.9373 10.4192 8.4881 8.30337 8.3613 8.41861 numMergedOcc 0
3 mol 10 unq 0 iso 1 dist 8.4881 10.4192 9.9373 8.41861 8.3613 8.30337 numMergedOcc 0
4 mol 10 unq 1 iso 0 dist 9.97671 10.4382 7.83087 14.6965 9.33141 8.30337 numMergedOcc 0
5 mol 10 unq 1 iso 1 dist 7.83087 10.4382 9.97671 8.30337 9.33141 14.6965 numMergedOcc 0
6 mol 10 unq 2 iso 0 dist 9.97671 9.06785 9.37129 14.6965 9.33141 8.41861 numMergedOcc 0
7 mol 10 unq 2 iso 1 dist 9.37129 9.06785 9.97671 8.41861 9.33141 14.6965 numMergedOcc 0
8 mol 10 unq 2 iso 0 dist 7.83087 10.4192 9.37129 8.30337 9.33141 8.41861 numMergedOcc 0
9 mol 10 unq 2 iso 1 dist 9.37129 10.4192 7.83087 8.41861 9.33141 8.30337 numMergedOcc 0
10 mol 28 unq 0 iso 0 dist 9.28621 12.5255 8.94643 7.26052 8.95154 6.23081 numMergedOcc 0
11 mol 28 unq 0 iso 1 dist 8.94643 12.5255 9.28621 6.23081 8.95154 7.26052 numMergedOcc 0
12 mol 28 unq 1 iso 0 dist 9.28621 9.40652 8.36195 7.26052 8.95154 10.3067 numMergedOcc 0
13 mol 28 unq 1 iso 1 dist 8.36195 9.40652 9.28621 10.3067 8.95154 7.26052 numMergedOcc 0
14 mol 28 unq 1 iso 0 dist 8.94643 11.2009 8.36195 6.23081 8.95154 10.3067 numMergedOcc 0
15 mol 28 unq 1 iso 1 dist 8.36195 11.2009 8.94643 10.3067 8.95154 6.23081 numMergedOcc 0
16 mol 34 unq 0 iso 0 dist 5.68794 4.75078 8.9964 9.83264 9.99939 13.7592 numMergedOcc 0
17 mol 34 unq 0 iso 1 dist 8.9964 4.75078 5.68794 13.7592 9.99939 9.83264 numMergedOcc 0
18 mol 48 unq 0 iso 0 dist 7.33788 5.43494 8.52681 8.8671 8.89047 12.9129 numMergedOcc 0
19 mol 48 unq 0 iso 1 dist 8.52681 5.43494 7.33788 12.9129 8.89047 8.8671 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 8.67342 9.06957 5.73739 7.96997 7.69926 9.51195 numMergedOcc 0
21 mol 85 unq 0 iso 1 dist 5.73739 9.06957 8.67342 9.51195 7.69926 7.96997 numMergedOcc 0
22 mol 85 unq 1 iso 0 dist 8.60062 9.06957 5.16225 7.96997 5.85237 9.51195 numMergedOcc 0
23 mol 85 unq 1 iso 1 dist 5.16225 9.06957 8.60062 9.51195 5.85237 7.96997 numMergedOcc 0
24 mol 85 unq 2 iso 0 dist 8.60062 9.06957 5.16225 14.6422 9.11768 14.228 numMergedOcc 0
25 mol 85 unq 2 iso 1 dist 5.16225 9.06957 8.60062 14.228 9.11768 14.6422 numMergedOcc 0
26 mol 88 unq 0 iso 0 dist 8.73208 4.39437 5.60174 6.49171 7.74064 7.86667 numMergedOcc 0
27 mol 88 unq 0 iso 1 dist 5.60174 4.39437 8.73208 7.86667 7.74064 6.49171 numMergedOcc 0
28 mol 167 unq 0 iso 0 dist 9.98672 4.34557 7.84707 6.05722 9.86868 8.90206 numMergedOcc 0
29 mol 167 unq 0 iso 1 dist 7.84707 4.34557 9.98672 8.90206 9.86868 6.05722 numMergedOcc 0
30 mol 251 unq 0 iso 0 dist 7.90148 10.7701 9.49019 10.2078 8.45764 8.97986 numMergedOcc 0
31 mol 251 unq 0 iso 1 dist 9.49019 10.7701 7.90148 8.97986 8.45764 10.2078 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 5.36518 5.40028 9.11585 11.9164 9.29666 17.05 numMergedOcc 0
33 mol 266 unq 0 iso 1 dist 9.11585 5.40028 5.36518 17.05 9.29666 11.9164 numMergedOcc 0
34 mol 277 unq 0 iso 0 dist 9.07744 12.752 8.42892 10.2486 9.54359 17.6138 numMergedOcc 0
35 mol 277 unq 0 iso 1 dist 8.42892 12.752 9.07744 17.6138 9.54359 10.2486 numMergedOcc 0
36 mol 277 unq 1 iso 0 dist 9.07744 12.752 8.42892 7.94155 5.69112 13.5116 numMergedOcc 0
37 mol 277 unq 1 iso 1 dist 8.42892 12.752 9.07744 13.5116 5.69112 7.94155 numMergedOcc 0
38 mol 277 unq 2 iso 0 dist 9.07744 15.2073 8.90967 10.2486 9.54359 11.006 numMergedOcc 0
39 mol 277 unq 2 iso 1 dist 8.90967 15.2073 9.07744 11.006 9.54359 10.2486 numMergedOcc 0
40 mol 277 unq 3 iso 0 dist 9.07744 15.2073 8.90967 7.94155 5.69112 7.72525 numMergedOcc 0
41 mol 277 unq 3 iso 1 dist 8.90967 15.2073 9.07744 7.72525 5.69112 7.94155 numMergedOcc 0
42 mol 277 unq 2 iso 0 dist 8.42892 15.6008 8.90967 17.6138 9.54359 11.006 numMergedOcc 0
43 mol 277 unq 2 iso 1 dist 8.90967 15.6008 8.42892 11.006 9.54359 17.6138 numMergedOcc 0
44 mol 277 unq 3 iso 0 dist 8.42892 15.6008 8.90967 13.5116 5.69112 7.72525 numMergedOcc 0
45 mol 277 unq 3 iso 1 dist 8.90967 15.6008 8.42892 7.72525 5.69112 13.5116 numMergedOcc 0
46 mol 281 unq 0 iso 0 dist 9.39268 15.6382 9.06888 7.85489 5.50053 8.21418 numMergedOcc 0
47 mol 281 unq 0 iso 1 dist 9.06888 15.6382 9.39268 8.21418 5.50053 7.85489 numMergedOcc 0
