0 mol 9 unq 0 iso 0 dist 9.79863 7.84963 12.863 13.0985 16.2483 8.59513 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 9.66589 7.94132 5.31518 5.99968 12.6699 8.99536 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 9.66589 7.94132 5.31518 3.96462 7.28599 5.94317 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.28161 5.48163 4.5216 4.00884 6.48163 6.89071 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 4.98783 7.7399 4.5216 4.1125 6.48163 6.89071 numMergedOcc 0
5 mol 92 unq 2 iso 0 dist 9.03472 8.23055 7.81379 7.47544 11.0483 8.43964 numMergedOcc 0
6 mol 92 unq 3 iso 0 dist 9.40274 8.30746 7.81379 4.16536 11.0483 8.43964 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.55124 6.13459 10.4066 12.9548 17.5689 7.48947 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 9.15172 7.08403 12.174 15.3457 18.9621 9.62952 numMergedOcc 0
9 mol 116 unq 0 iso 0 dist 8.51507 8.24233 5.28688 10.5065 13.4699 8.58308 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 6.59749 8.26128 6.64725 10.3128 13.7738 8.90588 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 8.35869 8.47543 10.8048 16.5533 20.0596 9.87447 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.52322 6.99587 7.93285 6.33168 11.7849 7.37629 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.52322 4.37577 8.70013 6.33168 11.7849 5.68985 numMergedOcc 0
14 mol 244 unq 0 iso 0 dist 8.19381 5.16859 5.2958 4.38246 5.60146 6.10489 numMergedOcc 0
15 mol 244 unq 1 iso 0 dist 8.19381 4.79207 7.02866 4.38246 5.60146 4.4204 numMergedOcc 0
16 mol 244 unq 2 iso 0 dist 8.93421 5.16859 11.2661 4.38246 12.8595 6.10489 numMergedOcc 0
17 mol 244 unq 3 iso 0 dist 8.93421 4.79207 13.4101 4.38246 12.8595 4.4204 numMergedOcc 0
18 mol 244 unq 4 iso 0 dist 7.35657 5.16859 7.64875 4.38246 9.80249 6.10489 numMergedOcc 0
19 mol 244 unq 5 iso 0 dist 7.35657 4.79207 11.5997 4.38246 9.80249 4.4204 numMergedOcc 0
20 mol 244 unq 6 iso 0 dist 6.19605 5.16859 9.20762 4.38246 10.4821 6.10489 numMergedOcc 0
21 mol 244 unq 7 iso 0 dist 6.19605 4.79207 9.06024 4.38246 10.4821 4.4204 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 7.91992 8.24013 3.60894 4.60075 7.88238 6.23115 numMergedOcc 0
23 mol 286 unq 0 iso 0 dist 9.02971 8.87916 7.36907 4.08297 11.5434 9.21276 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 9.2899 8.85506 3.77627 7.1944 6.68183 5.91617 numMergedOcc 0
