0 mol 7 unq 0 iso 0 dist 9.8603 9.33944 6.22805 15.8072 8.72114 13.6771 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.95165 5.51164 6.40513 4.46394 5.96346 4.54105 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 5.7435 5.42831 6.97875 4.08268 4.30695 6.15351 numMergedOcc 0
3 mol 11 unq 2 iso 0 dist 5.7435 5.42831 6.97875 4.24301 6.35398 4.69415 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.6396 16.5953 8.23292 4.32173 7.45383 14.4951 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 8.6396 16.5953 8.23292 16.0077 9.01548 6.39668 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 8.609 10.8023 8.37503 5.73417 8.1284 7.07473 numMergedOcc 0
7 mol 36 unq 0 iso 0 dist 8.13896 7.71418 6.29647 3.81015 8.07928 7.73079 numMergedOcc 0
8 mol 41 unq 0 iso 0 dist 5.41493 6.07784 4.68793 4.08339 8.51663 8.68242 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 9.3931 5.4965 8.30169 5.09984 5.73743 6.11478 numMergedOcc 0
10 mol 91 unq 1 iso 0 dist 9.3931 8.87123 8.91983 5.09984 5.73743 6.42704 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 8.30654 11.7934 7.5984 11.6678 7.78652 11.4055 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 8.30654 11.7934 7.5984 11.347 8.91301 9.54731 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 4.44292 7.64573 8.66709 5.45915 6.53347 12.1461 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 9.63873 13.739 6.56115 6.09134 9.07943 10.8796 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 6.07091 5.24208 6.01711 4.98945 9.61462 6.4423 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.73892 8.43876 5.79186 3.89957 7.29285 7.19337 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 8.46319 10.4685 5.79186 4.06474 7.29285 7.19337 numMergedOcc 0
18 mol 206 unq 2 iso 0 dist 9.36079 14.2215 8.73396 10.9922 6.16414 11.3915 numMergedOcc 0
19 mol 206 unq 3 iso 0 dist 9.36079 14.2215 8.73396 9.89331 7.33701 7.26571 numMergedOcc 0
20 mol 206 unq 4 iso 0 dist 9.36079 14.2215 8.73396 8.83984 8.0871 6.33838 numMergedOcc 0
21 mol 206 unq 5 iso 0 dist 9.11298 12.6603 5.79186 7.56231 7.29285 7.19337 numMergedOcc 0
22 mol 206 unq 6 iso 0 dist 7.42904 11.233 8.73396 8.16827 6.16414 11.3915 numMergedOcc 0
23 mol 206 unq 7 iso 0 dist 7.42904 11.233 8.73396 6.06766 7.33701 7.26571 numMergedOcc 0
24 mol 206 unq 8 iso 0 dist 7.42904 11.233 8.73396 5.82916 8.0871 6.33838 numMergedOcc 0
25 mol 212 unq 0 iso 0 dist 5.87223 10.1355 7.87125 9.39384 9.74144 11.7484 numMergedOcc 0
26 mol 212 unq 1 iso 0 dist 5.87223 10.1355 7.87125 6.48939 8.69988 7.05237 numMergedOcc 0
27 mol 212 unq 2 iso 0 dist 5.87223 10.1355 7.87125 5.81626 8.55903 11.3998 numMergedOcc 0
28 mol 212 unq 3 iso 0 dist 5.87223 10.1355 7.87125 5.94698 7.15603 7.67532 numMergedOcc 0
29 mol 212 unq 4 iso 0 dist 8.062 7.5418 7.87125 4.69067 9.74144 11.7484 numMergedOcc 0
30 mol 212 unq 5 iso 0 dist 8.062 7.5418 7.87125 10.4595 8.69988 7.05237 numMergedOcc 0
31 mol 212 unq 6 iso 0 dist 8.062 7.5418 7.87125 14.0193 8.55903 11.3998 numMergedOcc 0
32 mol 212 unq 7 iso 0 dist 8.062 7.5418 7.87125 4.18086 7.15603 7.67532 numMergedOcc 0
33 mol 212 unq 8 iso 0 dist 8.70011 11.1789 7.87125 5.37854 9.74144 11.7484 numMergedOcc 0
34 mol 212 unq 9 iso 0 dist 8.70011 11.1789 7.87125 8.87823 8.69988 7.05237 numMergedOcc 0
35 mol 212 unq 10 iso 0 dist 8.70011 11.1789 7.87125 10.7245 8.55903 11.3998 numMergedOcc 0
36 mol 212 unq 11 iso 0 dist 8.70011 11.1789 7.87125 3.74692 7.15603 7.67532 numMergedOcc 0
37 mol 218 unq 0 iso 0 dist 8.5119 5.55907 9.88212 4.87337 6.1951 8.22785 numMergedOcc 0
38 mol 222 unq 0 iso 0 dist 9.55777 12.6689 8.69148 12.979 7.67576 8.56453 numMergedOcc 0
39 mol 222 unq 1 iso 0 dist 9.55777 12.6689 8.69148 4.05539 9.82371 13.6076 numMergedOcc 0
40 mol 259 unq 0 iso 0 dist 8.06771 5.73217 6.96379 5.61261 7.98231 7.39099 numMergedOcc 0
