0 mol 11 unq 0 iso 0 dist 6.40513 5.9863 4.61088 4.54105 5.96346 6.86684 12.8569 8.68293 7.28643 13.5125 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.40513 5.9863 4.61088 4.54105 5.96346 6.86684 5.83448 6.84216 9.68636 6.76736 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.85331 9.20254 6.86014 10.7574 7.33768 4.32034 7.12984 7.49157 8.66248 7.02381 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.85331 9.20254 6.86014 10.7574 7.33768 4.32034 5.31288 7.73794 6.73521 7.18485 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.85331 9.20254 6.86014 15.2995 9.01567 8.67951 7.12984 7.49157 8.66248 13.4969 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.85331 9.20254 6.86014 15.2995 9.01567 8.67951 5.31288 7.73794 6.73521 13.9252 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 6.85331 9.20254 6.86014 12.8157 7.29868 8.52463 7.12984 7.49157 8.66248 14.1137 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 6.85331 9.20254 6.86014 12.8157 7.29868 8.52463 5.31288 7.73794 6.73521 13.4584 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 6.35095 5.76725 5.54419 8.7316 8.70827 5.59311 6.85946 8.23075 6.7846 12.2271 numMergedOcc 0
9 mol 24 unq 7 iso 0 dist 6.35095 5.76725 5.54419 8.7316 8.70827 5.59311 6.85662 4.7841 8.03955 12.6431 numMergedOcc 0
10 mol 24 unq 8 iso 0 dist 6.35095 5.76725 5.54419 10.9987 6.73939 12.176 6.85946 8.23075 6.7846 12.2839 numMergedOcc 0
11 mol 24 unq 9 iso 0 dist 6.35095 5.76725 5.54419 10.9987 6.73939 12.176 6.85662 4.7841 8.03955 6.22954 numMergedOcc 0
12 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 6.05353 9.81166 11.4997 4.79348 9.16597 4.74027 7.98253 numMergedOcc 0
13 mol 75 unq 1 iso 0 dist 7.118 5.06305 7.79912 9.08979 9.81166 11.4997 4.79489 9.16597 4.74027 7.98253 numMergedOcc 0
14 mol 102 unq 0 iso 0 dist 9.0361 7.49575 7.36792 13.32 8.31932 7.42011 6.04036 5.54256 3.48119 7.28191 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 7.5984 5.11989 5.99315 11.4055 7.78652 6.48978 5.08025 8.99891 9.14188 14.3396 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 7.5984 5.11989 5.99315 9.54731 8.91301 5.20762 5.08025 8.99891 9.14188 12.476 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 7.10166 5.15743 8.02137 14.2366 7.75885 12.7604 8.44261 6.23183 8.20841 9.36584 numMergedOcc 0
18 mol 206 unq 1 iso 0 dist 7.10166 13.609 9.774 14.2366 7.75885 6.45859 8.44261 6.23183 7.83734 9.36584 numMergedOcc 0
19 mol 206 unq 2 iso 0 dist 8.73396 6.35321 7.7366 11.3915 6.16414 6.45859 6.30581 4.51255 7.83734 9.36584 numMergedOcc 0
20 mol 206 unq 3 iso 0 dist 8.73396 6.35321 7.7366 7.26571 7.33701 4.40897 6.30581 4.51255 7.83734 8.97305 numMergedOcc 0
21 mol 206 unq 4 iso 0 dist 8.73396 6.35321 7.7366 6.33838 8.0871 7.62219 6.30581 4.51255 7.83734 8.90838 numMergedOcc 0
22 mol 206 unq 5 iso 0 dist 9.66896 15.7773 8.02137 5.91675 7.75885 12.7604 13.8891 6.23183 8.20841 9.36584 numMergedOcc 0
23 mol 206 unq 6 iso 0 dist 9.66896 12.0196 9.774 5.91675 7.75885 6.45859 13.8891 6.23183 7.83734 9.36584 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 6.53736 11.5481 6.18308 11.3924 7.10826 5.87279 10.061 6.85824 4.29623 4.73037 numMergedOcc 0
25 mol 210 unq 1 iso 0 dist 8.18851 8.72811 6.18308 8.48795 7.10826 5.87279 5.11839 6.85824 4.29623 4.73037 numMergedOcc 0
26 mol 222 unq 0 iso 0 dist 8.69148 6.52189 8.01589 8.56453 7.67576 10.3151 7.53235 5.1609 6.91863 3.98604 numMergedOcc 0
27 mol 222 unq 1 iso 0 dist 8.69148 6.52189 8.01589 13.6076 9.82371 8.52017 7.53235 5.1609 6.91863 7.99695 numMergedOcc 0
28 mol 222 unq 2 iso 0 dist 8.69148 5.33282 7.7699 8.56453 7.67576 7.81022 7.53235 5.1609 8.26703 3.98604 numMergedOcc 0
29 mol 222 unq 3 iso 0 dist 8.69148 5.33282 7.7699 13.6076 9.82371 15.7504 7.53235 5.1609 8.26703 7.99695 numMergedOcc 0
30 mol 222 unq 4 iso 0 dist 8.69148 9.97859 7.21333 8.56453 7.67576 7.75656 7.53235 5.1609 8.89157 3.98604 numMergedOcc 0
31 mol 222 unq 5 iso 0 dist 8.69148 9.97859 7.21333 13.6076 9.82371 16.0949 7.53235 5.1609 8.89157 7.99695 numMergedOcc 0
32 mol 231 unq 0 iso 0 dist 9.98232 10.9863 7.37839 11.1156 7.79066 9.0443 13.2586 9.9868 16.456 10.5016 numMergedOcc 0
33 mol 231 unq 1 iso 0 dist 9.98232 10.9863 7.37839 11.1156 7.79066 9.0443 12.8691 7.3268 6.63423 4.02097 numMergedOcc 0
34 mol 231 unq 2 iso 0 dist 9.98232 10.2117 8.40182 11.1156 7.79066 12.1512 13.2586 9.9868 17.7601 10.5016 numMergedOcc 0
35 mol 231 unq 3 iso 0 dist 9.98232 10.2117 8.40182 11.1156 7.79066 12.1512 12.8691 7.3268 10.3815 4.02097 numMergedOcc 0
36 mol 232 unq 0 iso 0 dist 7.47238 10.134 8.27212 15.5413 9.05071 8.80479 6.89215 8.25985 4.04428 12.159 numMergedOcc 0
37 mol 232 unq 1 iso 0 dist 7.47238 10.134 8.27212 15.5413 9.05071 8.80479 11.652 9.27788 4.22149 8.36223 numMergedOcc 0
