C,1,18.29,s,
C,2,77.38,s,
O,3,,,
C,4,99.79,s,
O,5,,,
C,6,40.4,s,
C,7,37.9,s,
C,8,36.24,s,
C,9,57.96,s,
C,10,134.23,s,
N,11,,,
C,12,136.4,s,
C,13,110.5,s,
C,14,121.27,s,
C,15,119.22,s,
C,16,118.08,s,
C,17,126.85,s,
C,18,105.63,s,
C,19,27.4,s,
C,20,62.1,s,
N,21,,,
C,22,86.56,s,
O,23,,,
C,24,40.4,s,
H,25,1.37,d,6.1
H,26,1.37,d,6.1
H,27,1.37,d,6.1
H,28,4.58,dq,"7.1,6.1"
H,29,5.2,d,4.2
H,30,,,
H,31,3.04,ddd,"4.2,3.3,3.0"
H,32,1.59,m,
H,33,1.87,ddd,"12.4,10.2,4.1"
H,34,1.87,ddd,"12.4,7.5,1.3"
H,35,5.19,dd,"10.2,7.5"
H,36,,,
H,37,7.32,ddd,"8.3,1.4,0.5"
H,38,7.18,ddd,"8.3,7.5,1.4"
H,39,7.13,ddd,"7.5,6.7,1.4"
H,40,7.53,ddd,"6.7,1.4,0.5"
H,41,3.21,dd,"15.4,9.8"
H,42,3.21,dd,"15.4,1.8"
H,43,3.6,ddd,"9.8,3.0,1.8"
H,44,5.52,d,4.4
H,45,,,
H,46,2.83,ddd,"7.1,4.4,2.1"
