C,1,56.06,s,
O,2,,,
C,3,154.16,s,
C,4,105.31,s,
C,5,133.27,s,
C,6,110.7,s,
C,7,123.86,s,
N,8,,,
C,9,137.2,s,
C,10,108.94,s,
C,11,148.39,s,
N,12,,,
C,13,162.22,s,
O,14,,,
C,15,53.54,s,
C,16,115.6,s,
C,17,126.45,s,
H,18,3.96,s,
H,19,3.96,s,
H,20,3.96,s,
H,21,7.45,dd,"1.4,0.5"
H,22,7.12,dd,"3.9,1.4"
H,23,7.09,dd,"3.9,0.5"
H,24,,,
H,25,8.21,d,6.0
H,26,8.59,d,6.0
H,27,4.07,s,
H,28,4.07,s,
H,29,4.07,s,
