0 mol 18 unq 0 iso 0 dist 8.95294 9.9807 8.52106 12.5254 9.35863 11.5747 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 8.95294 9.9807 8.52106 4.95319 5.04478 6.11048 numMergedOcc 0
2 mol 18 unq 2 iso 0 dist 8.95294 7.30649 6.32451 12.5254 9.35863 6.96996 numMergedOcc 0
3 mol 18 unq 3 iso 0 dist 8.95294 7.30649 6.32451 4.95319 5.04478 4.52259 numMergedOcc 0
4 mol 18 unq 4 iso 0 dist 7.19022 10.4866 8.52106 7.25833 9.35863 11.5747 numMergedOcc 0
5 mol 18 unq 5 iso 0 dist 7.19022 10.4866 8.52106 6.19959 5.04478 6.11048 numMergedOcc 0
6 mol 18 unq 6 iso 0 dist 7.19022 5.31135 6.32451 7.25833 9.35863 6.96996 numMergedOcc 0
7 mol 18 unq 7 iso 0 dist 7.19022 5.31135 6.32451 6.19959 5.04478 4.52259 numMergedOcc 0
8 mol 21 unq 0 iso 0 dist 9.34916 10.8106 6.08338 12.4315 9.35562 14.0241 numMergedOcc 0
9 mol 21 unq 1 iso 0 dist 9.34916 10.8106 6.08338 9.03671 8.63857 4.20001 numMergedOcc 0
10 mol 26 unq 0 iso 0 dist 9.10253 10.3363 8.82012 10.3466 5.84066 5.56139 numMergedOcc 0
11 mol 26 unq 1 iso 0 dist 9.10253 16.9524 9.16962 10.3466 5.84066 8.25132 numMergedOcc 0
12 mol 45 unq 0 iso 0 dist 7.62709 8.60899 9.20119 6.3858 5.81001 12.466 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 6.22513 5.49132 6.21982 9.90706 9.4866 5.31985 numMergedOcc 0
14 mol 76 unq 1 iso 0 dist 6.22513 6.71804 8.19682 9.90706 9.4866 15.4159 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 6.16039 5.26656 6.79146 6.20277 8.9677 4.66904 numMergedOcc 0
16 mol 130 unq 1 iso 0 dist 6.16039 10.6181 7.66168 6.20277 8.9677 11.1455 numMergedOcc 0
17 mol 130 unq 2 iso 0 dist 6.16039 9.86628 6.89257 6.20277 8.9677 7.52422 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 9.13913 13.5954 7.93331 15.1639 8.62366 12.4131 numMergedOcc 0
19 mol 173 unq 1 iso 0 dist 9.13913 13.5954 7.93331 15.4654 9.44973 8.85462 numMergedOcc 0
20 mol 173 unq 2 iso 0 dist 9.13913 13.5954 7.93331 15.2591 6.52508 6.91529 numMergedOcc 0
21 mol 173 unq 3 iso 0 dist 9.13913 9.29369 6.98095 15.1639 8.62366 12.5815 numMergedOcc 0
22 mol 173 unq 4 iso 0 dist 9.13913 9.29369 6.98095 15.4654 9.44973 9.65654 numMergedOcc 0
23 mol 173 unq 5 iso 0 dist 9.13913 9.29369 6.98095 15.2591 6.52508 9.44845 numMergedOcc 0
24 mol 173 unq 6 iso 0 dist 9.13913 15.713 8.31897 15.1639 8.62366 8.63452 numMergedOcc 0
25 mol 173 unq 7 iso 0 dist 9.13913 15.713 8.31897 15.4654 9.44973 4.83786 numMergedOcc 0
26 mol 173 unq 8 iso 0 dist 9.13913 15.713 8.31897 15.2591 6.52508 3.74688 numMergedOcc 0
27 mol 175 unq 0 iso 0 dist 9.15536 10.5343 9.31887 6.48113 9.76114 5.00913 numMergedOcc 0
28 mol 184 unq 0 iso 0 dist 7.95111 7.25468 9.52936 11.7525 7.59939 13.8904 numMergedOcc 0
29 mol 184 unq 1 iso 0 dist 7.95111 8.82012 9.15417 11.7525 7.59939 10.3179 numMergedOcc 0
30 mol 194 unq 0 iso 0 dist 9.61621 7.67708 6.15769 4.9686 6.54481 5.97754 numMergedOcc 0
31 mol 213 unq 0 iso 0 dist 7.53384 5.97098 6.0965 9.77052 8.65196 10.1881 numMergedOcc 0
32 mol 214 unq 0 iso 0 dist 5.77917 7.05305 7.46831 10.7932 8.70987 11.1534 numMergedOcc 0
33 mol 214 unq 1 iso 0 dist 5.77917 6.33863 8.60247 10.7932 8.70987 7.19184 numMergedOcc 0
34 mol 228 unq 0 iso 0 dist 7.39392 12.4165 9.42615 3.92449 8.6457 10.0586 numMergedOcc 0
35 mol 228 unq 1 iso 0 dist 7.39392 12.4165 9.42615 8.98871 8.8055 4.76982 numMergedOcc 0
36 mol 228 unq 2 iso 0 dist 8.04854 11.6016 8.06181 11.3048 7.84881 9.3302 numMergedOcc 0
37 mol 228 unq 3 iso 0 dist 8.04854 9.07296 8.38048 11.3048 7.84881 6.49596 numMergedOcc 0
38 mol 228 unq 4 iso 0 dist 8.04854 6.03966 7.65132 11.3048 7.84881 6.30327 numMergedOcc 0
39 mol 228 unq 5 iso 0 dist 8.04854 7.74541 8.53764 11.3048 7.84881 11.9013 numMergedOcc 0
40 mol 228 unq 6 iso 0 dist 7.56863 12.0882 9.06121 3.77407 8.66946 9.80263 numMergedOcc 0
41 mol 228 unq 7 iso 0 dist 7.56863 12.0882 9.06121 8.68063 8.55761 4.63053 numMergedOcc 0
42 mol 228 unq 8 iso 0 dist 8.08612 11.6723 7.77367 11.2792 7.86746 9.39743 numMergedOcc 0
43 mol 228 unq 9 iso 0 dist 8.08612 9.04318 8.20909 11.2792 7.86746 6.65033 numMergedOcc 0
44 mol 228 unq 10 iso 0 dist 8.08612 6.25423 7.94506 11.2792 7.86746 6.19376 numMergedOcc 0
45 mol 228 unq 11 iso 0 dist 8.08612 7.61976 8.15494 11.2792 7.86746 11.8243 numMergedOcc 0
46 mol 238 unq 0 iso 0 dist 9.83326 5.18756 6.05141 5.27781 8.69525 5.27215 numMergedOcc 0
47 mol 238 unq 1 iso 0 dist 9.83326 9.55101 8.09066 5.27781 8.69525 6.13368 numMergedOcc 0
48 mol 238 unq 2 iso 0 dist 9.83326 13.5175 7.2766 5.27781 8.69525 10.0605 numMergedOcc 0
49 mol 238 unq 3 iso 0 dist 6.19514 6.13639 6.05141 4.12472 8.69525 5.27215 numMergedOcc 0
50 mol 238 unq 4 iso 0 dist 6.19514 5.59848 8.09066 4.12472 8.69525 6.13368 numMergedOcc 0
51 mol 238 unq 5 iso 0 dist 6.19514 7.17967 7.2766 4.12472 8.69525 10.0605 numMergedOcc 0
