C,1,22.07,s,
C,2,92.83,s,
O,3,,,
C,4,163.15,s,
C,5,111.2,s,
C,6,165.4,s,
O,7,,,
N,8,,,
C,9,137.9,s,
C,10,116.75,s,
C,11,129.95,s,
C,12,122.6,s,
C,13,121.6,s,
C,14,115.35,s,
C,15,41.24,s,
C,16,21.36,s,
C,17,21.36,s,
H,18,1.31,d,6.2
H,19,1.31,d,6.2
H,20,1.31,d,6.2
H,21,4.52,q,6.2
H,22,,,
H,23,7.15,ddd,"7.0,1.4,0.5"
H,24,7.22,ddd,"7.0,6.7,1.4"
H,25,7.35,ddd,"7.3,6.7,1.4"
H,26,7.56,ddd,"7.3,1.4,0.5"
H,27,1.13,s,
H,28,1.13,s,
H,29,1.13,s,
H,30,1.13,s,
H,31,1.13,s,
H,32,1.13,s,
