0 mol 13 unq 0 iso 0 dist 8.47514 6.26071 6.34527 10.5634 9.57403 8.00865 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 8.47514 6.26071 6.34527 12.0488 14.9077 9.11447 numMergedOcc 0
2 mol 13 unq 2 iso 0 dist 7.39086 8.43325 6.34527 8.66829 9.57403 8.00865 numMergedOcc 0
3 mol 13 unq 3 iso 0 dist 7.39086 8.43325 6.34527 14.2112 14.9077 9.11447 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 9.97476 9.16649 6.99656 9.34878 12.2669 6.25866 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 8.79811 6.28351 5.44624 8.59354 10.4039 5.1101 numMergedOcc 0
6 mol 147 unq 1 iso 0 dist 8.79811 6.28351 5.44624 8.54341 10.1025 7.01133 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 9.74081 7.88319 5.45107 6.63727 11.2097 6.39981 numMergedOcc 0
8 mol 175 unq 0 iso 0 dist 6.62757 7.35824 11.923 11.1651 16.7849 7.01126 numMergedOcc 0
9 mol 175 unq 1 iso 0 dist 6.62757 9.17364 15.6544 11.1651 16.7849 6.58434 numMergedOcc 0
10 mol 175 unq 2 iso 0 dist 9.36354 7.35824 6.17754 11.1651 12.945 7.01126 numMergedOcc 0
11 mol 175 unq 3 iso 0 dist 9.36354 9.17364 12.6929 11.1651 12.945 6.58434 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 6.02579 6.72641 8.62127 10.5203 15.0608 9.59034 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 5.62219 7.63018 5.64437 10.9823 11.1831 6.4829 numMergedOcc 0
14 mol 240 unq 0 iso 0 dist 5.31041 9.47583 10.9678 10.7371 12.5233 8.33853 numMergedOcc 0
15 mol 240 unq 1 iso 0 dist 5.31041 9.47583 10.9678 13.9225 14.6704 5.66537 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 9.00426 5.26434 9.46424 7.49174 16.4241 9.24121 numMergedOcc 0
17 mol 261 unq 1 iso 0 dist 8.19348 5.26434 7.48263 7.49174 15.0524 9.24121 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 8.97468 9.05222 4.61714 5.7074 6.59109 7.35433 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 8.76788 5.23193 9.47915 7.30164 15.2493 9.96468 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 8.76788 5.23193 9.47915 8.36249 17.0297 9.59817 numMergedOcc 0
21 mol 282 unq 2 iso 0 dist 8.39723 5.23193 7.5377 7.30164 15.4248 9.96468 numMergedOcc 0
22 mol 282 unq 3 iso 0 dist 8.39723 5.23193 7.5377 8.36249 15.9287 9.59817 numMergedOcc 0
23 mol 282 unq 4 iso 0 dist 9.15503 5.23193 5.50344 7.30164 10.2021 9.96468 numMergedOcc 0
24 mol 282 unq 5 iso 0 dist 9.15503 5.23193 5.50344 8.36249 8.0574 9.59817 numMergedOcc 0
