0 mol 2 unq 0 iso 0 dist 9.9335 10.8368 6.15195 11.0608 9.04604 3.83471 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.9335 6.38677 7.37296 11.0608 9.04604 8.66587 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.73496 5.53899 9.36839 8.99663 8.6405 8.07507 numMergedOcc 0
3 mol 10 unq 0 iso 0 dist 9.48775 16.5806 8.99402 12.0181 6.05338 5.30796 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 8.71324 13.6999 9.3473 11.0644 7.72437 5.41569 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 9.5663 12.6498 6.08228 11.197 8.61926 7.41847 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 7.70037 13.7644 8.36667 8.3355 5.29487 9.46017 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 7.96207 4.70213 8.36667 6.60943 5.29487 9.46017 numMergedOcc 0
8 mol 102 unq 0 iso 0 dist 6.7095 13.457 8.63522 6.87786 6.793 7.99081 numMergedOcc 0
9 mol 102 unq 1 iso 0 dist 6.7095 10.8385 5.43401 6.87786 6.793 6.83631 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 7.11102 15.1019 9.95726 5.42714 9.99454 14.5771 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 7.03253 6.37593 8.50054 9.31887 8.98551 12.8248 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 7.03253 6.87055 7.47653 9.31887 8.98551 7.89412 numMergedOcc 0
13 mol 130 unq 2 iso 0 dist 7.03253 6.09126 8.97124 9.31887 8.98551 5.1247 numMergedOcc 0
14 mol 165 unq 0 iso 0 dist 7.22838 14.3514 9.59989 13.2131 8.4082 5.48376 numMergedOcc 0
15 mol 189 unq 0 iso 0 dist 9.36549 12.9479 7.04604 7.24071 4.96433 5.87044 numMergedOcc 0
16 mol 189 unq 1 iso 0 dist 6.77351 6.32602 8.23197 5.73928 7.65477 7.92946 numMergedOcc 0
17 mol 189 unq 2 iso 0 dist 6.77351 6.32602 8.23197 7.24071 8.2926 11.791 numMergedOcc 0
18 mol 189 unq 3 iso 0 dist 6.77351 6.32602 8.23197 9.17194 9.31713 4.97214 numMergedOcc 0
19 mol 189 unq 4 iso 0 dist 8.4676 9.84174 8.23197 13.1851 7.65477 7.92946 numMergedOcc 0
20 mol 189 unq 5 iso 0 dist 8.4676 9.84174 8.23197 13.7587 8.2926 11.791 numMergedOcc 0
21 mol 189 unq 6 iso 0 dist 8.4676 9.84174 8.23197 14.0451 9.31713 4.97214 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 5.99718 9.55761 8.23246 7.59322 8.89838 4.6069 numMergedOcc 0
23 mol 226 unq 0 iso 0 dist 6.3687 12.3798 7.20862 11.8345 7.45381 6.05562 numMergedOcc 0
24 mol 227 unq 0 iso 0 dist 8.32703 5.55239 5.2851 5.66663 6.20188 6.07589 numMergedOcc 0
25 mol 227 unq 1 iso 0 dist 8.32703 5.55239 5.2851 11.0954 9.47836 9.95811 numMergedOcc 0
26 mol 227 unq 2 iso 0 dist 8.25412 5.34424 5.2851 5.52296 6.20188 6.07589 numMergedOcc 0
27 mol 227 unq 3 iso 0 dist 8.25412 5.34424 5.2851 6.32385 9.47836 9.95811 numMergedOcc 0
28 mol 239 unq 0 iso 0 dist 8.49961 13.8894 8.34832 5.89364 9.51945 15.8519 numMergedOcc 0
29 mol 266 unq 0 iso 0 dist 9.46926 11.7148 8.61786 8.76358 5.45375 4.75686 numMergedOcc 0
30 mol 266 unq 1 iso 0 dist 9.46926 11.7148 8.61786 10.6001 9.9145 10.8282 numMergedOcc 0
31 mol 266 unq 2 iso 0 dist 9.46926 7.8329 8.42706 8.76358 5.45375 10.3992 numMergedOcc 0
32 mol 266 unq 3 iso 0 dist 9.46926 7.8329 8.42706 10.6001 9.9145 15.5784 numMergedOcc 0
33 mol 278 unq 0 iso 0 dist 6.03414 5.49004 8.87405 7.70648 9.95186 4.8589 numMergedOcc 0
34 mol 284 unq 0 iso 0 dist 9.70969 9.73593 9.1882 12.7407 8.7448 5.56094 numMergedOcc 0
35 mol 284 unq 1 iso 0 dist 9.70969 10.1709 8.60951 12.7407 8.7448 4.93259 numMergedOcc 0
