0 mol 78 unq 0 iso 0 dist 8.90372 9.29446 13.9318 13.5358 18.6828 7.69072 numMergedOcc 0
1 mol 78 unq 1 iso 0 dist 6.09124 9.29446 4.81535 13.5358 11.8354 7.69072 numMergedOcc 0
2 mol 110 unq 0 iso 0 dist 7.34054 7.77678 4.60073 10.0513 12.9646 9.10911 numMergedOcc 0
3 mol 110 unq 1 iso 0 dist 7.36326 7.77678 5.33778 10.0513 7.59747 9.10911 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.23558 7.2443 7.46917 4.8668 13.2263 8.99912 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 8.36066 6.44195 6.95651 5.71332 11.2337 8.89394 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 9.33818 6.53913 9.37794 5.60897 8.0697 5.36671 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 8.51999 6.28961 8.10912 12.9917 9.75644 9.37946 numMergedOcc 0
8 mol 169 unq 1 iso 0 dist 8.51999 6.28961 8.10912 12.2955 15.1636 9.13646 numMergedOcc 0
9 mol 169 unq 2 iso 0 dist 8.51999 6.28961 8.10912 11.6543 16.0971 8.34216 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.59599 6.0639 9.21913 4.59453 7.00382 9.65093 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 7.76429 6.0639 11.1768 4.59453 10.974 9.65093 numMergedOcc 0
12 mol 186 unq 2 iso 0 dist 7.73733 6.0639 7.03438 4.59453 12.0394 9.65093 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.63592 8.57514 9.7129 13.7017 18.7649 9.31158 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 5.64116 6.11505 9.7129 13.9601 18.7649 9.31158 numMergedOcc 0
15 mol 218 unq 0 iso 0 dist 6.25383 9.79816 5.09263 5.27483 6.46335 7.84952 numMergedOcc 0
16 mol 252 unq 0 iso 0 dist 6.74917 7.91348 5.91451 5.45887 10.4988 8.55044 numMergedOcc 0
17 mol 252 unq 1 iso 0 dist 6.31608 7.91348 4.52914 5.45887 5.2116 8.55044 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 9.00434 6.95233 9.65978 4.5731 7.43884 9.29666 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.581 8.66941 8.52993 10.3675 15.137 7.42932 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 6.87362 8.66941 10.2752 10.3675 15.1493 7.42932 numMergedOcc 0
21 mol 281 unq 0 iso 0 dist 6.76971 9.27716 11.6589 7.60311 11.6039 5.50053 numMergedOcc 0
22 mol 281 unq 1 iso 0 dist 6.76971 9.27716 11.6589 11.1675 14.2852 7.33334 numMergedOcc 0
23 mol 281 unq 2 iso 0 dist 9.68891 9.27716 17.1255 7.60311 14.4196 5.50053 numMergedOcc 0
24 mol 281 unq 3 iso 0 dist 9.68891 9.27716 17.1255 11.1675 16.551 7.33334 numMergedOcc 0
