0 mol 4 unq 0 iso 0 dist 6.05231 3.25279 5.51567 6.34563 4.83806 7.77633 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.79863 3.96333 9.47528 6.76332 4.8178 5.18338 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.31452 6.23648 6.47443 7.99404 8.65597 9.06457 numMergedOcc 0
3 mol 20 unq 0 iso 0 dist 9.60039 12.5088 9.22796 14.4004 5.86427 7.61139 numMergedOcc 0
4 mol 37 unq 0 iso 0 dist 8.26833 5.04485 8.51021 7.7568 5.12933 8.98454 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 6.29817 3.97541 6.10658 6.95914 5.65741 4.33805 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.52322 3.6848 7.12029 9.71223 4.83829 9.82338 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 8.52322 5.33968 8.56602 9.71223 4.83829 7.99933 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 9.9224 3.81315 9.62225 7.252 7.4314 7.578 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 9.9224 3.81315 9.62225 10.957 9.81428 9.24926 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 9.08655 3.86206 9.26885 10.7356 4.99222 9.51368 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 6.9612 7.95009 5.66071 9.89207 5.11289 5.08438 numMergedOcc 0
12 mol 195 unq 1 iso 0 dist 4.86882 6.61517 5.66071 9.0153 5.11289 5.08438 numMergedOcc 0
13 mol 207 unq 0 iso 0 dist 7.98453 9.63192 8.01415 15.9922 10.3669 8.72885 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 6.64341 7.79226 9.94612 10.884 6.30987 9.03056 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 7.31315 11.122 9.94612 12.7925 6.30987 9.03056 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.52954 4.46929 6.50932 6.44932 7.34151 8.31344 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 5.83646 3.72761 5.41453 9.25424 12.2489 8.28643 numMergedOcc 0
18 mol 247 unq 0 iso 0 dist 7.85081 7.1875 5.52484 13.429 11.346 7.95874 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 9.83374 13.0429 8.28809 18.4509 11.2108 9.45329 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 5.75335 5.19474 8.28809 10.9089 11.2108 9.45329 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 9.69083 12.9436 8.39635 8.80555 5.2842 9.60873 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 5.96202 3.77125 8.39635 8.80418 5.2842 9.60873 numMergedOcc 0
23 mol 283 unq 2 iso 0 dist 9.55068 11.2772 8.39635 13.3976 5.2842 9.60873 numMergedOcc 0
