C,1,21.01,s,
C,2,30.4,s,
C,3,43.1,s,
C,4,38.9,s,
C,5,43.3,s,
C,6,,,
O,7,,,
C,8,49.08,s,
C,9,32.61,s,
C,10,41.32,s,
C,11,62.1,s,
C,12,36.24,s,
N,13,,,
C,14,40.25,s,
C,15,53.83,s,
H,16,0.89,d,6.4
H,17,0.89,d,6.4
H,18,0.89,d,6.4
H,19,1.49,m,
H,20,1.89,ddd,"12.4,2.9,0.6"
H,21,1.89,ddd,"12.4,11.2,3.9"
H,22,2.75,m,
H,23,2.74,dd,"15.4,10.1"
H,24,2.74,dd,"15.4,7.8"
H,25,2.83,m,
H,26,1.66,ddd,"12.4,3.3,2.7"
H,27,1.66,ddd,"12.4,2.9,2.6"
H,28,2.26,m,
H,29,3.6,ddd,"5.0,3.4,3.1"
H,30,1.87,ddd,"12.4,12.1,3.4"
H,31,1.87,ddd,"12.4,3.1,2.3"
H,32,2.26,s,
H,33,2.26,s,
H,34,2.26,s,
H,35,3.31,dd,"12.4,7.9"
H,36,3.31,dd,"12.4,0.8"
