0 mol 6 unq 0 iso 0 dist 9.46936 7.46244 9.7718 10.5254 9.1305 7.12528 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.26043 6.6473 11.8657 4.44768 6.64564 9.5194 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 7.10403 8.53833 5.82517 4.40557 9.1662 12.1158 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 8.49761 5.93365 8.82571 10.0549 7.67429 13.6407 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 9.26609 5.20001 9.72458 8.64874 9.83596 12.4075 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.13344 7.33743 15.4631 6.45157 4.69402 13.1452 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 5.68406 5.24228 4.62155 10.2381 9.28415 5.56446 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 8.73423 8.73525 5.9546 4.92057 8.40718 10.0718 numMergedOcc 0
8 mol 266 unq 0 iso 0 dist 8.3978 7.81168 5.85295 7.87257 9.36806 13.0277 numMergedOcc 0
9 mol 266 unq 1 iso 0 dist 8.3978 7.81168 5.85295 11.6181 7.51446 12.9819 numMergedOcc 0
10 mol 279 unq 0 iso 0 dist 7.86721 8.88095 6.83947 9.33832 6.39586 11.0854 numMergedOcc 0
