0 mol 19 unq 0 iso 0 dist 7.14945 4.96753 5.64498 5.6031 5.53102 4.01494 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.50337 5.5841 5.64498 8.7083 5.53102 4.01494 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 9.39046 12.5816 7.19596 5.12224 8.19319 11.0759 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 9.27081 5.72183 5.5683 11.2681 9.99577 10.0577 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 9.27081 5.72183 5.5683 9.83759 8.40203 10.1794 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 9.854 11.7069 6.31321 9.34239 8.52567 10.6383 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 8.23749 12.2937 6.31321 5.79698 8.52567 10.6383 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 9.61935 5.30257 9.32713 7.35297 5.97918 4.05114 numMergedOcc 0
8 mol 107 unq 0 iso 0 dist 7.02709 13.3045 9.00913 10.1994 6.71858 13.8812 numMergedOcc 0
9 mol 107 unq 1 iso 0 dist 7.02709 13.3045 9.00913 12.9752 9.37159 17.5181 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 5.62219 5.44149 9.98534 11.3763 8.96211 14.4183 numMergedOcc 0
11 mol 219 unq 0 iso 0 dist 7.68645 4.74167 6.30365 11.3569 6.44817 8.80389 numMergedOcc 0
12 mol 219 unq 1 iso 0 dist 7.68645 4.74167 6.30365 9.13819 9.36547 7.20516 numMergedOcc 0
13 mol 219 unq 2 iso 0 dist 7.68645 11.4067 5.47325 11.3569 6.44817 6.92627 numMergedOcc 0
14 mol 219 unq 3 iso 0 dist 7.68645 11.4067 5.47325 9.13819 9.36547 9.04688 numMergedOcc 0
15 mol 219 unq 4 iso 0 dist 5.75017 4.9853 6.30365 4.78402 6.44817 8.80389 numMergedOcc 0
16 mol 219 unq 5 iso 0 dist 5.75017 4.9853 6.30365 11.6561 9.36547 7.20516 numMergedOcc 0
17 mol 219 unq 6 iso 0 dist 5.75017 7.97735 5.47325 4.78402 6.44817 6.92627 numMergedOcc 0
18 mol 219 unq 7 iso 0 dist 5.75017 7.97735 5.47325 11.6561 9.36547 9.04688 numMergedOcc 0
19 mol 219 unq 8 iso 0 dist 6.12768 11.0147 6.30365 8.8527 6.44817 8.80389 numMergedOcc 0
20 mol 219 unq 9 iso 0 dist 6.12768 11.0147 6.30365 11.1178 9.36547 7.20516 numMergedOcc 0
21 mol 219 unq 10 iso 0 dist 6.12768 4.52622 5.47325 8.8527 6.44817 6.92627 numMergedOcc 0
22 mol 219 unq 11 iso 0 dist 6.12768 4.52622 5.47325 11.1178 9.36547 9.04688 numMergedOcc 0
23 mol 219 unq 12 iso 0 dist 7.19159 7.87195 6.30365 11.4193 6.44817 8.80389 numMergedOcc 0
24 mol 219 unq 13 iso 0 dist 7.19159 7.87195 6.30365 4.72332 9.36547 7.20516 numMergedOcc 0
25 mol 219 unq 14 iso 0 dist 7.19159 5.13707 5.47325 11.4193 6.44817 6.92627 numMergedOcc 0
26 mol 219 unq 15 iso 0 dist 7.19159 5.13707 5.47325 4.72332 9.36547 9.04688 numMergedOcc 0
27 mol 282 unq 0 iso 0 dist 9.15503 8.36249 8.0574 10.7217 9.48877 8.36839 numMergedOcc 0
28 mol 283 unq 0 iso 0 dist 8.25636 6.85947 7.8959 9.63618 8.47034 7.07802 numMergedOcc 0
29 mol 283 unq 1 iso 0 dist 8.25636 6.85947 7.8959 9.82243 8.57491 4.47708 numMergedOcc 0
30 mol 285 unq 0 iso 0 dist 8.89057 5.12507 9.19077 10.3198 5.087 11.3939 numMergedOcc 0
31 mol 285 unq 1 iso 0 dist 7.97266 11.6907 9.19077 5.26233 5.087 11.3939 numMergedOcc 0
