C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,51.67,s,
N,5,,,
C,6,56.97,s,
C,7,25.5,s,
C,8,42.38,s,
C,9,48.9,s,
C,10,62.1,s,
C,11,37.6,s,
C,12,65.1,s,
C,13,183.25,s,
N,14,,,
C,15,157.05,s,
C,16,121.35,s,
C,17,128.83,s,
C,18,125.7,s,
C,19,124.15,s,
C,20,136.85,s,
C,21,77.8,s,
O,22,,,
C,23,170.0,s,
C,24,21.05,s,
O,25,,,
H,26,1.67,d,7.0
H,27,1.67,d,7.0
H,28,1.67,d,7.0
H,29,5.45,q,7.0
H,30,3.82,s,
H,31,3.82,s,
H,32,4.4,d,8.0
H,33,0.93,dd,"12.4,6.4"
H,34,0.93,ddd,"12.4,8.0,1.5"
H,35,2.99,ddd,"6.4,5.0,1.5"
H,36,2.46,ddd,"7.7,5.0,1.5"
H,37,3.6,ddd,"7.7,3.7,1.0"
H,38,2.7,dd,"12.4,3.7"
H,39,2.7,dd,"12.4,1.0"
H,40,7.61,ddd,"7.2,1.4,0.5"
H,41,7.33,ddd,"8.6,7.2,1.4"
H,42,7.21,ddd,"8.6,6.7,1.4"
H,43,7.42,ddd,"6.7,1.4,0.5"
H,44,4.97,d,1.5
H,45,2.05,s,
H,46,2.05,s,
H,47,2.05,s,
