0 mol 24 unq 0 iso 0 dist 9.67926 7.63824 10.9551 11.6096 16.5276 5.9372 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.67926 7.63824 10.9551 10.8208 15.5426 6.93597 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.87317 6.35997 7.58092 4.38622 6.40741 7.37118 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.77714 6.77802 6.38985 4.31769 6.99001 8.40186 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 7.37244 9.2397 4.97794 4.31691 7.50825 6.76315 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 8.21723 6.29267 8.33013 6.0425 12.9306 6.2576 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 8.21723 6.29267 8.33013 11.8739 16.8282 8.96069 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 8.21723 6.29267 8.33013 11.9735 15.5412 7.56495 numMergedOcc 0
8 mol 111 unq 0 iso 0 dist 7.95205 6.33923 4.58626 12.6461 14.1286 9.72371 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 5.69775 8.06631 8.5036 4.31676 8.18186 8.65859 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 7.7267 8.42277 8.17376 10.1785 15.3408 8.98175 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.22039 7.53591 4.45608 7.84926 9.80549 9.62774 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.26891 8.50487 4.8443 8.56345 11.714 8.90588 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 9.83634 6.51748 15.7254 6.99918 15.4169 4.6512 numMergedOcc 0
14 mol 158 unq 1 iso 0 dist 9.83634 6.51748 15.7254 6.83901 10.5168 9.45696 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 7.9678 6.2669 10.4274 4.45301 6.05667 7.13824 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 6.55208 9.2684 10.1478 6.33919 10.3937 7.63543 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 8.51073 8.6212 3.76721 6.47507 10.705 9.47429 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 6.30852 8.6212 8.33181 6.47507 11.0977 9.47429 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 8.45487 5.2862 4.93279 9.28495 12.4653 7.74874 numMergedOcc 0
20 mol 284 unq 1 iso 0 dist 8.72299 5.31097 4.93279 7.85427 12.4653 7.74874 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 4.28058 8.4625 7.24849 13.0927 13.9091 9.25759 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 4.28058 8.4625 7.24849 13.0927 13.9091 9.25759 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 4.28058 8.4625 7.24849 13.0927 13.9091 9.25759 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 7.71392 4.83062 9.89492 10.5335 13.9949 9.01437 numMergedOcc 0
25 mol 294 unq 1 iso 0 dist 6.6112 8.65363 9.89492 9.08006 13.9949 9.01437 numMergedOcc 0
26 mol 294 unq 2 iso 0 dist 5.02677 4.83062 9.32362 10.5335 15.2994 9.01437 numMergedOcc 0
27 mol 294 unq 3 iso 0 dist 8.34193 8.65363 9.32362 9.08006 15.2994 9.01437 numMergedOcc 0
28 mol 294 unq 4 iso 0 dist 7.6859 4.83062 4.45227 10.5335 6.1268 9.01437 numMergedOcc 0
29 mol 294 unq 5 iso 0 dist 8.35722 8.65363 4.45227 9.08006 6.1268 9.01437 numMergedOcc 0
