0 mol 11 unq 0 iso 0 dist 9.76233 4.54527 9.07476 6.64342 6.84216 5.8961 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 7.30231 10.8382 6.09533 9.88653 9.1397 6.47139 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 5.61831 5.94401 6.46582 5.66392 7.61521 8.78063 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 4.30961 4.3613 6.3323 7.12509 7.44558 11.1132 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 9.27028 16.1275 7.08403 4.83846 7.02367 14.0364 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 4.60192 4.36058 6.01857 7.23362 7.42146 11.1675 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 6.66313 7.36057 8.42225 4.93421 4.80684 7.38295 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 6.66313 7.36057 8.42225 9.5414 7.60162 15.0071 numMergedOcc 0
8 mol 119 unq 2 iso 0 dist 6.3646 11.1403 8.42225 7.79347 4.80684 7.38295 numMergedOcc 0
9 mol 119 unq 3 iso 0 dist 6.3646 11.1403 8.42225 6.77381 7.60162 15.0071 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 7.64841 9.0362 8.03124 8.90504 8.38358 6.81949 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 5.55632 7.0408 8.26128 10.0762 8.89394 5.88662 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 8.88037 10.6672 8.95296 7.79718 5.36671 6.32863 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 8.88037 4.74884 6.10021 7.79718 5.36671 5.48405 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.19926 11.641 9.14525 11.8143 5.90765 4.94882 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.34984 7.48068 8.71119 5.34337 9.19385 11.8779 numMergedOcc 0
16 mol 253 unq 1 iso 0 dist 8.34984 7.48068 8.71119 11.9048 9.1927 15.4152 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 8.95095 12.7366 9.60767 7.6323 6.76495 6.71528 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 8.95095 12.7366 9.60767 6.30874 5.4557 11.6193 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 7.34927 9.49228 8.72101 6.29035 9.54359 4.88964 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 7.34927 9.49228 8.72101 4.83355 5.69112 6.76786 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 7.34927 11.7966 5.11998 6.29035 9.54359 14.2115 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 7.34927 11.7966 5.11998 4.83355 5.69112 10.8075 numMergedOcc 0
23 mol 277 unq 4 iso 0 dist 7.54315 16.1206 8.72101 15.7541 9.54359 4.88964 numMergedOcc 0
24 mol 277 unq 5 iso 0 dist 7.54315 16.1206 8.72101 11.2857 5.69112 6.76786 numMergedOcc 0
25 mol 277 unq 6 iso 0 dist 7.54315 7.00586 5.11998 15.7541 9.54359 14.2115 numMergedOcc 0
26 mol 277 unq 7 iso 0 dist 7.54315 7.00586 5.11998 11.2857 5.69112 10.8075 numMergedOcc 0
27 mol 277 unq 8 iso 0 dist 7.88615 10.5169 8.75619 12.1011 7.2091 6.76786 numMergedOcc 0
28 mol 277 unq 9 iso 0 dist 7.88615 12.8601 5.79925 12.1011 7.2091 10.8075 numMergedOcc 0
29 mol 277 unq 10 iso 0 dist 7.88615 8.85294 8.55906 12.1011 7.2091 12.9535 numMergedOcc 0
30 mol 277 unq 11 iso 0 dist 7.88615 4.2416 5.55523 12.1011 7.2091 11.2385 numMergedOcc 0
31 mol 281 unq 0 iso 0 dist 8.78416 6.85714 6.82918 6.83107 5.50053 7.74992 numMergedOcc 0
32 mol 281 unq 1 iso 0 dist 9.22428 16.6962 9.13909 6.83107 7.33334 13.6632 numMergedOcc 0
33 mol 281 unq 2 iso 0 dist 9.22428 6.85714 4.29351 6.83107 7.33334 7.74992 numMergedOcc 0
34 mol 281 unq 3 iso 0 dist 7.82358 12.3603 6.82918 5.22248 5.50053 7.74992 numMergedOcc 0
35 mol 281 unq 4 iso 0 dist 7.95687 9.0331 9.13909 12.5417 7.33334 13.6632 numMergedOcc 0
36 mol 281 unq 5 iso 0 dist 7.95687 5.28494 4.29351 12.5417 7.33334 7.74992 numMergedOcc 0
