0 mol 16 unq 0 iso 0 dist 9.47421 5.66097 5.47769 7.88676 5.1298 5.84479 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.47421 6.06561 6.58035 7.88676 5.1298 8.67719 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.53875 5.92411 6.91734 6.79881 4.94373 5.94778 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 9.77131 6.626 6.91734 11.6605 4.94373 5.94778 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 8.64746 6.41829 9.54144 7.24183 5.78769 6.6003 numMergedOcc 0
5 mol 87 unq 0 iso 0 dist 7.2668 11.442 8.93296 17.4588 11.9014 8.50159 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 6.793 7.49575 9.94856 5.43401 6.83631 9.10229 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 8.40972 5.55582 6.15769 7.38622 5.45144 7.32478 numMergedOcc 0
8 mol 194 unq 1 iso 0 dist 8.40972 5.55582 6.15769 8.82165 10.0346 9.48439 numMergedOcc 0
9 mol 194 unq 2 iso 0 dist 7.03163 6.12629 6.15769 10.0816 5.45144 7.32478 numMergedOcc 0
10 mol 194 unq 3 iso 0 dist 7.03163 6.12629 6.15769 13.547 10.0346 9.48439 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 5.00266 6.19375 6.99002 7.57712 7.84277 7.31105 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 8.76325 6.87755 7.06793 11.9987 11.7838 6.56437 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 8.76325 6.87755 7.06793 7.58998 9.57742 6.23882 numMergedOcc 0
14 mol 224 unq 2 iso 0 dist 8.76325 6.87755 7.06793 15.2131 8.30442 9.53131 numMergedOcc 0
15 mol 224 unq 3 iso 0 dist 8.76325 6.87755 7.06793 12.0605 5.46434 9.34636 numMergedOcc 0
16 mol 224 unq 4 iso 0 dist 8.85101 11.0252 7.06793 16.8876 11.7838 6.56437 numMergedOcc 0
17 mol 224 unq 5 iso 0 dist 8.85101 11.0252 7.06793 12.3857 9.57742 6.23882 numMergedOcc 0
18 mol 224 unq 6 iso 0 dist 8.85101 11.0252 7.06793 16.7035 8.30442 9.53131 numMergedOcc 0
19 mol 224 unq 7 iso 0 dist 8.85101 11.0252 7.06793 11.2964 5.46434 9.34636 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 6.20188 5.14019 5.86443 5.2851 6.07589 9.18675 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 9.47836 5.14019 7.22914 5.2851 9.95811 9.18675 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.40309 7.01206 7.67322 5.57184 6.23871 5.24313 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 7.87164 11.2453 9.29858 17.8634 18.4149 9.31417 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 7.87164 11.2453 9.29858 16.0826 14.7671 5.56719 numMergedOcc 0
25 mol 248 unq 0 iso 0 dist 9.83514 9.48478 6.07192 8.11968 4.11367 8.71859 numMergedOcc 0
26 mol 249 unq 0 iso 0 dist 9.02486 6.28944 8.96876 6.18866 4.16447 5.78121 numMergedOcc 0
27 mol 249 unq 1 iso 0 dist 9.02486 12.5843 8.83735 6.18866 4.16447 7.29898 numMergedOcc 0
28 mol 249 unq 2 iso 0 dist 9.02486 12.5843 8.83735 9.3807 6.74838 8.91685 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 6.73928 4.6881 6.49982 8.97411 5.28906 5.73296 numMergedOcc 0
30 mol 259 unq 0 iso 0 dist 9.44826 7.02254 7.50578 12.1069 10.8128 5.90381 numMergedOcc 0
31 mol 278 unq 0 iso 0 dist 8.56781 4.69872 6.35287 10.1334 4.8589 9.82774 numMergedOcc 0
32 mol 278 unq 1 iso 0 dist 9.95186 8.66976 6.35287 8.87405 4.8589 9.82774 numMergedOcc 0
33 mol 284 unq 0 iso 0 dist 8.7448 4.59796 7.52785 8.60951 4.93259 8.10742 numMergedOcc 0
