0 mol 5 unq 0 iso 0 dist 6.04331 4.07788 9.21695 9.25426 9.93582 8.71514 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 6.98764 7.88171 5.55524 7.29104 9.00426 4.61584 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 9.9919 7.74667 7.38017 5.95912 6.20227 3.98483 numMergedOcc 0
3 mol 20 unq 0 iso 0 dist 8.45034 13.3556 9.4228 12.221 8.81141 5.65401 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.00709 10.3841 7.11686 4.77736 5.06241 7.81701 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 6.00709 12.947 9.43467 4.77736 5.06241 8.5929 numMergedOcc 0
6 mol 54 unq 2 iso 0 dist 6.00709 10.3082 8.41018 4.77736 5.06241 6.17649 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 7.9399 4.47138 9.854 11.9965 9.64488 14.6648 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 7.9399 4.16095 8.23749 11.9965 9.64488 9.25557 numMergedOcc 0
9 mol 63 unq 0 iso 0 dist 8.20976 13.2118 8.79583 6.02306 9.82368 10.113 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.27456 4.49 8.77199 4.39271 6.00564 6.37974 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 9.27456 5.8457 8.81824 4.39271 6.00564 5.08358 numMergedOcc 0
12 mol 91 unq 0 iso 0 dist 5.11803 6.88024 7.37948 9.08676 9.29087 8.1837 numMergedOcc 0
13 mol 107 unq 0 iso 0 dist 8.83855 8.49615 7.02709 11.0367 6.93417 8.71052 numMergedOcc 0
14 mol 107 unq 1 iso 0 dist 8.83855 8.49615 7.02709 3.85355 6.36246 8.38463 numMergedOcc 0
15 mol 113 unq 0 iso 0 dist 9.43487 11.0812 5.82487 14.2684 8.97819 12.4467 numMergedOcc 0
16 mol 113 unq 1 iso 0 dist 9.97052 8.67499 5.82487 11.5713 8.97819 12.4467 numMergedOcc 0
17 mol 113 unq 2 iso 0 dist 7.3324 5.19652 5.82487 14.7564 8.97819 12.4467 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 6.29634 12.1192 8.20715 9.79485 8.81779 7.61939 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 6.29634 5.3154 6.16081 9.79485 8.81779 10.326 numMergedOcc 0
20 mol 120 unq 0 iso 0 dist 9.13829 9.32263 8.5457 5.1682 9.32166 9.756 numMergedOcc 0
21 mol 120 unq 1 iso 0 dist 9.13829 9.45514 6.7928 5.1682 9.32166 11.6877 numMergedOcc 0
22 mol 120 unq 2 iso 0 dist 9.13829 11.5746 7.59189 5.1682 9.32166 14.5665 numMergedOcc 0
23 mol 120 unq 3 iso 0 dist 5.90276 5.95039 8.5457 8.25036 9.32166 9.756 numMergedOcc 0
24 mol 120 unq 4 iso 0 dist 5.90276 4.09501 6.7928 8.25036 9.32166 11.6877 numMergedOcc 0
25 mol 120 unq 5 iso 0 dist 5.90276 6.81436 7.59189 8.25036 9.32166 14.5665 numMergedOcc 0
26 mol 120 unq 6 iso 0 dist 8.565 14.645 8.5457 17.4169 9.32166 9.756 numMergedOcc 0
27 mol 120 unq 7 iso 0 dist 8.565 10.2082 6.7928 17.4169 9.32166 11.6877 numMergedOcc 0
28 mol 120 unq 8 iso 0 dist 8.565 6.13307 7.59189 17.4169 9.32166 14.5665 numMergedOcc 0
29 mol 162 unq 0 iso 0 dist 8.99034 6.00067 9.48488 5.5367 6.00293 5.45934 numMergedOcc 0
30 mol 175 unq 0 iso 0 dist 8.49856 4.27736 6.62757 6.61278 6.59925 4.24624 numMergedOcc 0
31 mol 186 unq 0 iso 0 dist 8.71602 4.94882 9.16817 10.2652 7.9637 13.586 numMergedOcc 0
32 mol 214 unq 0 iso 0 dist 9.05875 7.65735 7.06087 11.6166 7.48626 6.214 numMergedOcc 0
33 mol 218 unq 0 iso 0 dist 6.02521 4.94196 6.48765 5.68266 6.45821 5.282 numMergedOcc 0
34 mol 219 unq 0 iso 0 dist 8.15287 5.0241 7.68645 13.6251 9.09124 15.8259 numMergedOcc 0
35 mol 219 unq 1 iso 0 dist 8.15287 4.36122 5.75017 13.6251 9.09124 10.1178 numMergedOcc 0
36 mol 219 unq 2 iso 0 dist 8.15287 14.0703 6.12768 13.6251 9.09124 8.27974 numMergedOcc 0
37 mol 219 unq 3 iso 0 dist 8.15287 13.25 7.19159 13.6251 9.09124 13.6754 numMergedOcc 0
38 mol 219 unq 4 iso 0 dist 8.72341 14.1934 7.68645 13.0856 9.09124 15.8259 numMergedOcc 0
39 mol 219 unq 5 iso 0 dist 8.72341 13.288 5.75017 13.0856 9.09124 10.1178 numMergedOcc 0
40 mol 219 unq 6 iso 0 dist 8.72341 4.95329 6.12768 13.0856 9.09124 8.27974 numMergedOcc 0
41 mol 219 unq 7 iso 0 dist 8.72341 4.26247 7.19159 13.0856 9.09124 13.6754 numMergedOcc 0
42 mol 251 unq 0 iso 0 dist 6.32455 12.3975 9.207 9.21735 6.12282 14.7239 numMergedOcc 0
43 mol 251 unq 1 iso 0 dist 6.32455 12.3975 9.207 4.6808 6.99995 11.4518 numMergedOcc 0
44 mol 276 unq 0 iso 0 dist 6.11207 10.8564 8.75833 8.39039 9.2211 13.5875 numMergedOcc 0
