0 mol 7 unq 0 iso 0 dist 6.22805 5.99355 5.72491 13.3926 12.2041 7.88043 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.4523 14.045 7.032 10.2649 5.06358 7.9944 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.46752 6.76292 6.56335 11.6025 5.5251 7.2668 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 7.84393 4.93362 6.36455 11.4946 10.6598 7.48847 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 7.84393 4.93362 6.36455 10.1953 5.03957 6.92532 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.35095 6.80952 4.93188 12.4687 12.3067 9.24958 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 5.87895 9.6739 9.24958 11.0381 12.3067 4.93188 numMergedOcc 0
7 mol 38 unq 0 iso 0 dist 7.57586 8.4072 7.05737 10.3065 5.64331 7.54179 numMergedOcc 0
8 mol 38 unq 1 iso 0 dist 8.86547 9.36454 7.54179 11.7939 5.64331 7.05737 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 6.30194 14.8714 8.73253 10.392 5.4148 7.04044 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 5.79954 5.67493 7.04044 10.4766 5.4148 8.73253 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.01889 11.2215 7.04044 10.997 5.4148 8.73253 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 8.20865 5.09562 5.74854 9.49799 7.72877 5.88354 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 8.20865 5.09562 5.74854 12.129 11.0242 7.89665 numMergedOcc 0
14 mol 98 unq 2 iso 0 dist 8.20865 5.09562 5.74854 10.0009 5.09649 5.39354 numMergedOcc 0
15 mol 98 unq 3 iso 0 dist 8.20865 5.09562 5.74854 13.1775 11.9511 8.76566 numMergedOcc 0
16 mol 98 unq 4 iso 0 dist 8.20865 5.09562 5.74854 11.3099 11.569 8.8368 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 8.39771 14.6851 7.55384 12.9387 4.98336 5.34214 numMergedOcc 0
18 mol 109 unq 1 iso 0 dist 7.4371 5.02505 8.67766 10.4795 6.48636 8.0831 numMergedOcc 0
19 mol 112 unq 0 iso 0 dist 8.35164 5.51584 6.78038 9.43616 4.8896 6.47042 numMergedOcc 0
20 mol 112 unq 1 iso 0 dist 9.43616 5.51584 6.47042 8.35164 4.8896 6.78038 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.07833 4.97043 7.20392 11.44 10.1912 6.51749 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 7.45401 8.19136 7.20574 11.5381 5.74635 6.85302 numMergedOcc 0
23 mol 186 unq 1 iso 0 dist 6.86297 8.88762 6.85302 10.7452 5.74635 7.20574 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.14819 6.83084 8.0144 12.4821 11.117 7.80841 numMergedOcc 0
25 mol 212 unq 0 iso 0 dist 9.1384 13.7645 8.57827 7.87125 4.12932 6.29767 numMergedOcc 0
26 mol 212 unq 1 iso 0 dist 7.87125 13.7645 6.29767 9.1384 4.12932 8.57827 numMergedOcc 0
27 mol 214 unq 0 iso 0 dist 7.77535 4.08418 7.05523 11.9696 12.7897 8.46327 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 8.0007 7.57247 5.77318 12.776 7.0298 8.92743 numMergedOcc 0
29 mol 229 unq 1 iso 0 dist 8.0007 7.57247 5.77318 13.2481 5.5729 8.08082 numMergedOcc 0
30 mol 229 unq 2 iso 0 dist 8.0007 7.57247 5.77318 10.7479 9.96077 8.19603 numMergedOcc 0
31 mol 229 unq 3 iso 0 dist 9.92027 5.77507 8.19603 12.4161 15.7694 8.92743 numMergedOcc 0
32 mol 229 unq 4 iso 0 dist 9.92027 5.77507 8.19603 11.2816 11.3041 8.08082 numMergedOcc 0
33 mol 229 unq 5 iso 0 dist 9.92027 5.77507 8.19603 11.1915 9.96077 5.77318 numMergedOcc 0
34 mol 230 unq 0 iso 0 dist 8.56954 6.46721 9.09271 9.23938 5.53477 7.44838 numMergedOcc 0
35 mol 230 unq 1 iso 0 dist 9.23938 6.46721 7.44838 8.56954 5.53477 9.09271 numMergedOcc 0
36 mol 235 unq 0 iso 0 dist 7.93727 3.94313 7.75722 10.1494 12.1984 6.39158 numMergedOcc 0
37 mol 240 unq 0 iso 0 dist 6.01168 14.3522 9.47583 7.72928 4.28414 8.44909 numMergedOcc 0
38 mol 240 unq 1 iso 0 dist 7.72928 14.3522 8.44909 6.01168 4.28414 9.47583 numMergedOcc 0
39 mol 240 unq 2 iso 0 dist 6.83069 8.30926 9.47583 9.30995 4.28414 8.44909 numMergedOcc 0
40 mol 240 unq 3 iso 0 dist 9.30995 8.30926 8.44909 6.83069 4.28414 9.47583 numMergedOcc 0
41 mol 248 unq 0 iso 0 dist 6.44967 4.01898 6.17052 11.4848 5.55137 9.77666 numMergedOcc 0
42 mol 258 unq 0 iso 0 dist 7.9357 11.517 7.99477 13.7159 7.26417 6.70815 numMergedOcc 0
43 mol 258 unq 1 iso 0 dist 7.9357 5.04382 7.86627 5.79537 5.30627 7.93574 numMergedOcc 0
44 mol 258 unq 2 iso 0 dist 8.81059 15.4617 7.99477 14.0712 7.26417 6.70815 numMergedOcc 0
45 mol 258 unq 3 iso 0 dist 8.81059 11.0527 7.86627 9.12006 5.30627 7.93574 numMergedOcc 0
46 mol 258 unq 4 iso 0 dist 9.47519 7.38682 7.93574 11.9494 5.30627 7.86627 numMergedOcc 0
47 mol 258 unq 5 iso 0 dist 5.79537 5.04382 7.93574 7.9357 5.30627 7.86627 numMergedOcc 0
48 mol 258 unq 6 iso 0 dist 9.12006 11.0527 7.93574 8.81059 5.30627 7.86627 numMergedOcc 0
49 mol 261 unq 0 iso 0 dist 8.50313 11.2562 8.60026 11.3146 7.00201 5.26434 numMergedOcc 0
50 mol 261 unq 1 iso 0 dist 7.6414 13.4429 8.60026 13.063 7.00201 5.26434 numMergedOcc 0
51 mol 264 unq 0 iso 0 dist 6.80096 5.04055 6.42588 10.9135 8.96144 7.52281 numMergedOcc 0
