0 mol 1 unq 0 iso 0 dist 7.21349 6.4181 6.25854 7.90928 9.45781 5.11735 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.36227 7.46102 8.79328 8.16743 12.0906 4.85329 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.36227 9.47227 4.45895 8.16743 12.0906 10.8135 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 9.36227 9.91301 8.5845 8.16743 12.0906 12.9498 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.6112 6.88695 4.09495 9.97117 9.57165 7.23546 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 9.25641 9.96265 16.532 7.23261 11.0273 5.87283 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 9.25641 9.96265 16.532 6.20069 8.71322 10.6223 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 4.67917 8.05508 5.29688 8.17564 8.85727 14.134 numMergedOcc 0
8 mol 59 unq 1 iso 0 dist 4.67917 9.00229 11.0325 8.17564 8.85727 14.9359 numMergedOcc 0
9 mol 59 unq 2 iso 0 dist 5.81747 8.05508 12.0007 8.17564 4.07863 14.134 numMergedOcc 0
10 mol 59 unq 3 iso 0 dist 5.81747 9.00229 10.9658 8.17564 4.07863 14.9359 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 9.4022 8.09199 7.19147 8.39101 4.42702 4.93067 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 8.92399 9.44916 4.41538 9.4909 9.26242 5.7835 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 6.91762 4.44292 5.01007 7.62575 5.92486 5.40375 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 5.75545 9.58911 8.58814 8.45395 6.22085 10.5753 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 5.75545 9.58911 8.58814 5.41368 4.48609 5.88819 numMergedOcc 0
16 mol 185 unq 0 iso 0 dist 9.56016 9.878 8.20407 8.60027 11.0188 8.59032 numMergedOcc 0
17 mol 185 unq 1 iso 0 dist 7.92501 9.878 4.83776 8.60027 7.3365 8.59032 numMergedOcc 0
18 mol 187 unq 0 iso 0 dist 7.81168 9.36086 12.368 8.26654 13.0397 6.62321 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 9.718 8.62103 14.2438 6.87234 10.1799 11.9386 numMergedOcc 0
20 mol 210 unq 1 iso 0 dist 9.718 8.62103 14.2438 8.72017 5.48047 15.2792 numMergedOcc 0
21 mol 210 unq 2 iso 0 dist 8.61629 8.62103 11.4281 6.87234 8.05096 11.9386 numMergedOcc 0
22 mol 210 unq 3 iso 0 dist 8.61629 8.62103 11.4281 8.72017 6.25356 15.2792 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 8.80167 4.84709 5.67031 9.39099 16.3761 10.7373 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 8.61427 7.0843 6.32514 8.27907 10.0899 6.05563 numMergedOcc 0
25 mol 218 unq 1 iso 0 dist 8.61427 7.73315 9.20709 8.27907 10.0899 9.68444 numMergedOcc 0
26 mol 218 unq 2 iso 0 dist 8.61427 6.9398 5.53181 8.27907 10.0899 11.4148 numMergedOcc 0
27 mol 219 unq 0 iso 0 dist 7.13496 4.87446 4.95329 7.15624 6.19264 4.52622 numMergedOcc 0
28 mol 219 unq 1 iso 0 dist 7.13496 7.49235 4.26247 7.15624 6.19264 5.13707 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 8.92054 9.11256 5.23741 8.19915 5.52698 4.65302 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 9.51177 8.59074 5.65577 9.46582 13.1765 13.7993 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 9.51177 8.59074 5.65577 9.77231 14.6367 13.069 numMergedOcc 0
32 mol 244 unq 0 iso 0 dist 5.06669 7.65388 11.6777 9.7208 12.8067 13.8674 numMergedOcc 0
33 mol 244 unq 1 iso 0 dist 5.65248 7.65388 7.45211 9.7208 13.5223 13.8674 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 5.30455 9.12507 8.70769 8.46351 6.58569 5.32839 numMergedOcc 0
35 mol 259 unq 1 iso 0 dist 7.34794 9.12507 10.0253 8.46351 5.63099 5.32839 numMergedOcc 0
