0 mol 43 unq 0 iso 0 dist 9.57204 9.92963 5.52151 9.35453 11.5745 9.82546 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.57204 8.07389 17.1394 9.35453 11.5745 10.9858 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 8.32335 8.32098 3.77207 7.32157 7.25098 10.0734 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 8.79798 7.69672 8.72232 6.15011 10.8873 12.4367 numMergedOcc 0
4 mol 173 unq 0 iso 0 dist 8.68723 8.12102 8.51683 8.76228 14.253 9.00139 numMergedOcc 0
5 mol 173 unq 1 iso 0 dist 8.68723 7.95138 8.00155 8.76228 14.253 7.55884 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.21359 9.02321 6.00812 6.0685 5.98082 10.9995 numMergedOcc 0
7 mol 209 unq 0 iso 0 dist 5.2106 5.35602 4.85227 8.3505 6.88424 4.00393 numMergedOcc 0
8 mol 224 unq 0 iso 0 dist 6.44393 6.0626 4.233 7.32216 5.41562 4.09076 numMergedOcc 0
9 mol 224 unq 1 iso 0 dist 6.44393 6.0626 4.233 9.92206 10.9214 6.69164 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 6.82475 7.79729 13.8183 5.98104 11.1737 3.81221 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 8.55696 9.85095 10.1989 8.31182 4.76167 12.6333 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 8.55696 8.25191 14.0197 8.31182 4.76167 15.5391 numMergedOcc 0
13 mol 266 unq 2 iso 0 dist 8.55696 7.35056 11.8306 8.31182 4.76167 13.1627 numMergedOcc 0
14 mol 266 unq 3 iso 0 dist 7.45814 9.85095 11.7636 8.31182 15.7179 12.6333 numMergedOcc 0
15 mol 266 unq 4 iso 0 dist 7.45814 8.25191 6.24489 8.31182 15.7179 15.5391 numMergedOcc 0
16 mol 266 unq 5 iso 0 dist 7.45814 7.35056 8.82644 8.31182 15.7179 13.1627 numMergedOcc 0
17 mol 270 unq 0 iso 0 dist 8.0831 8.19788 14.5987 6.97639 4.53766 11.4433 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.24507 8.20612 10.1731 6.59092 6.30473 9.23974 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 7.64708 7.89017 10.9993 7.64361 12.5151 6.17749 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 5.73065 7.89017 3.87167 7.64361 5.10104 6.17749 numMergedOcc 0
