0 mol 11 unq 0 iso 0 dist 5.96346 8.68293 13.5125 8.05213 8.73067 16.1955 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.96346 6.84216 6.76736 8.05213 8.73067 4.79838 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 4.30695 8.01262 6.03873 7.27724 7.56871 5.67087 numMergedOcc 0
3 mol 11 unq 3 iso 0 dist 4.30695 6.58046 8.84131 7.27724 7.56871 10.4826 numMergedOcc 0
4 mol 11 unq 4 iso 0 dist 6.35398 8.01262 12.9584 7.85924 9.09091 15.2717 numMergedOcc 0
5 mol 11 unq 5 iso 0 dist 6.35398 6.58046 6.51674 7.85924 9.09091 5.25331 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 6.41423 7.7312 5.31883 4.69858 5.82366 6.38574 numMergedOcc 0
7 mol 32 unq 0 iso 0 dist 7.99969 8.91596 10.8132 6.68431 4.62858 10.9253 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 7.21955 9.4278 4.97525 6.75888 8.71468 13.2217 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 5.37007 4.17838 3.77771 9.97281 7.1539 10.4834 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 6.84011 9.93438 5.99273 5.31367 8.809 12.6545 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 6.84011 9.93438 5.99273 8.88748 5.79343 7.93956 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 8.70296 8.80895 5.92118 7.90484 9.2235 13.4143 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 9.87644 9.3273 5.16197 4.29204 8.00449 9.68074 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 7.78652 8.99891 14.3396 10.0989 6.97487 17.8205 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 7.78652 8.99891 14.3396 6.01455 6.46089 14.9694 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 7.44629 8.92592 5.71136 8.67522 7.60254 10.0147 numMergedOcc 0
17 mol 168 unq 1 iso 0 dist 7.44629 9.57452 5.46307 8.67522 7.60254 11.9783 numMergedOcc 0
18 mol 174 unq 0 iso 0 dist 9.87122 5.61673 9.87207 8.37744 7.47932 12.194 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 6.22122 9.70481 13.4378 10.5753 9.06217 11.7261 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 6.22122 9.70481 13.4378 5.88819 7.13252 7.61421 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 5.94469 8.29467 3.63671 6.7991 7.05653 6.91878 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 7.76163 6.93931 5.70845 10.5203 9.84492 12.4834 numMergedOcc 0
23 mol 235 unq 0 iso 0 dist 9.55668 8.08965 6.82702 4.65302 7.95766 9.11149 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 7.41478 9.7255 4.50383 6.56344 5.98039 8.33629 numMergedOcc 0
25 mol 237 unq 1 iso 0 dist 6.99315 9.14911 5.74428 10.1861 7.55103 12.7193 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 8.94014 8.94231 13.4894 10.8635 7.04753 11.209 numMergedOcc 0
27 mol 238 unq 1 iso 0 dist 7.02333 8.88652 13.4894 5.68826 7.04753 11.209 numMergedOcc 0
28 mol 238 unq 2 iso 0 dist 8.67864 6.46771 13.4894 4.87097 7.04753 11.209 numMergedOcc 0
29 mol 265 unq 0 iso 0 dist 6.71375 9.28128 12.6979 4.65134 5.40318 13.5427 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 8.91712 9.18744 3.96271 4.62998 5.59555 7.77225 numMergedOcc 0
31 mol 287 unq 1 iso 0 dist 9.65934 5.30118 5.39801 7.23534 5.59555 5.50067 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 8.91712 9.18744 3.96271 4.62998 5.59555 7.77225 numMergedOcc 0
33 mol 288 unq 1 iso 0 dist 9.65934 5.30118 5.39801 7.23534 5.59555 5.50067 numMergedOcc 0
34 mol 289 unq 0 iso 0 dist 8.91712 9.18744 3.96271 4.62998 5.59555 7.77225 numMergedOcc 0
35 mol 289 unq 1 iso 0 dist 9.65934 5.30118 5.39801 7.23534 5.59555 5.50067 numMergedOcc 0
