0 mol 11 unq 0 iso 0 dist 6.50001 4.46394 6.859 5.95165 4.10106 5.96346 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.54508 10.5851 8.49709 15.9016 13.0212 9.01567 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.36381 6.53276 4.44526 9.54519 5.50396 8.23446 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.36381 6.81998 9.586 9.54519 5.50396 8.75662 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.36381 6.81998 9.586 12.511 14.4081 9.44691 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 8.94703 4.04757 9.98592 6.11056 4.79736 8.44664 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 5.77745 4.32173 5.20109 8.40051 5.63212 6.16347 numMergedOcc 0
7 mol 25 unq 1 iso 0 dist 5.77745 4.32173 5.20109 8.6396 6.47509 7.45383 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 9.63803 10.5687 6.07276 14.5062 5.56139 6.46104 numMergedOcc 0
9 mol 26 unq 1 iso 0 dist 9.63803 10.5687 6.07276 14.2765 7.73394 7.36856 numMergedOcc 0
10 mol 41 unq 0 iso 0 dist 4.47883 9.73623 6.21128 17.2956 13.4019 8.51663 numMergedOcc 0
11 mol 41 unq 1 iso 0 dist 6.07514 7.10946 6.21128 13.3754 13.4019 8.51663 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 8.85156 4.37642 9.53438 9.01612 6.57389 9.92355 numMergedOcc 0
13 mol 58 unq 1 iso 0 dist 8.85156 4.37642 9.53438 6.36193 4.23671 5.93884 numMergedOcc 0
14 mol 58 unq 2 iso 0 dist 8.85156 4.37642 9.53438 4.88613 5.6823 7.68678 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.54368 9.64683 8.93769 13.8027 6.95017 7.52354 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 5.33961 9.96465 8.46823 14.4342 10.4782 6.65501 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 8.3505 7.43001 4.62494 5.9747 3.9764 6.65501 numMergedOcc 0
18 mol 98 unq 2 iso 0 dist 9.29816 13.7832 8.46823 16.5524 10.4782 6.65501 numMergedOcc 0
19 mol 98 unq 3 iso 0 dist 5.08983 12.5752 8.46823 12.3884 10.4782 6.65501 numMergedOcc 0
20 mol 109 unq 0 iso 0 dist 9.46621 4.03135 7.56755 11.1103 5.00433 7.80523 numMergedOcc 0
21 mol 109 unq 1 iso 0 dist 9.94704 4.81814 7.56755 8.3164 5.00433 7.80523 numMergedOcc 0
22 mol 119 unq 0 iso 0 dist 9.10803 6.49348 6.18678 6.18763 9.85023 8.00003 numMergedOcc 0
23 mol 129 unq 0 iso 0 dist 6.53559 4.92611 6.34626 6.38163 6.28232 7.58957 numMergedOcc 0
24 mol 129 unq 1 iso 0 dist 8.09774 6.15789 6.34626 12.0922 6.28232 7.58957 numMergedOcc 0
25 mol 155 unq 0 iso 0 dist 7.25009 8.61147 9.16358 10.6076 4.91785 7.92304 numMergedOcc 0
26 mol 155 unq 1 iso 0 dist 7.25009 5.45915 9.24038 10.449 12.6999 8.69157 numMergedOcc 0
27 mol 155 unq 2 iso 0 dist 7.25009 5.45915 9.24038 4.44292 7.10286 6.53347 numMergedOcc 0
28 mol 171 unq 0 iso 0 dist 6.51523 4.98945 7.47964 6.07091 7.5383 9.61462 numMergedOcc 0
29 mol 171 unq 1 iso 0 dist 6.76574 4.47323 5.74846 9.87873 7.15048 6.64834 numMergedOcc 0
30 mol 171 unq 2 iso 0 dist 6.76574 4.47323 5.74846 10.2921 9.14311 5.93786 numMergedOcc 0
31 mol 171 unq 3 iso 0 dist 6.76574 4.47323 5.74846 11.2403 13.6262 8.24693 numMergedOcc 0
32 mol 171 unq 4 iso 0 dist 6.76574 4.47323 5.74846 9.80706 3.65288 7.36698 numMergedOcc 0
33 mol 186 unq 0 iso 0 dist 6.26168 5.18732 9.99396 11.5247 14.106 7.76163 numMergedOcc 0
34 mol 186 unq 1 iso 0 dist 6.26168 5.18732 9.99396 9.44405 10.8286 8.73217 numMergedOcc 0
35 mol 188 unq 0 iso 0 dist 7.6482 5.15888 8.66624 11.4309 9.71636 7.14503 numMergedOcc 0
36 mol 212 unq 0 iso 0 dist 5.03184 6.48939 9.10288 5.87223 3.9436 8.69988 numMergedOcc 0
37 mol 212 unq 1 iso 0 dist 5.03184 5.81626 6.19798 5.87223 3.9436 8.55903 numMergedOcc 0
38 mol 235 unq 0 iso 0 dist 5.39924 4.32578 7.39085 9.49136 13.089 6.36341 numMergedOcc 0
39 mol 235 unq 1 iso 0 dist 5.39924 4.32578 7.39085 10.127 10.5354 6.21292 numMergedOcc 0
40 mol 235 unq 2 iso 0 dist 5.39924 4.32578 7.39085 12.4271 11.3865 9.21736 numMergedOcc 0
41 mol 274 unq 0 iso 0 dist 4.97796 6.70266 9.65868 10.0379 14.7507 7.46394 numMergedOcc 0
42 mol 274 unq 1 iso 0 dist 4.97796 6.70266 9.65868 6.55855 8.87855 9.45514 numMergedOcc 0
43 mol 274 unq 2 iso 0 dist 4.97796 6.70266 9.65868 12.5213 12.5615 8.91672 numMergedOcc 0
44 mol 274 unq 3 iso 0 dist 4.97796 6.70266 9.65868 9.52894 13.0867 7.1729 numMergedOcc 0
45 mol 274 unq 4 iso 0 dist 4.97796 5.15747 8.60027 12.6706 16.9539 8.52587 numMergedOcc 0
46 mol 274 unq 5 iso 0 dist 4.97796 5.15747 8.60027 6.55855 8.87855 6.39866 numMergedOcc 0
47 mol 274 unq 6 iso 0 dist 7.15079 9.95931 7.77765 9.87411 5.22914 7.46394 numMergedOcc 0
48 mol 274 unq 7 iso 0 dist 7.15079 9.95931 7.77765 9.7198 12.393 9.45514 numMergedOcc 0
49 mol 274 unq 8 iso 0 dist 7.15079 9.95931 7.77765 17.4438 16.5034 8.91672 numMergedOcc 0
50 mol 274 unq 9 iso 0 dist 7.15079 9.95931 7.77765 11.9968 10.2884 7.1729 numMergedOcc 0
