C,1,9.9,s,
C,2,27.29,s,
C,3,174.63,s,
N,4,,,
C,5,55.8,s,
C,6,38.34,s,
C,7,53.0,s,
C,8,174.7,s,
O,9,,,
N,10,,,
O,11,,,
C,12,63.4,s,
C,13,138.3,s,
C,14,107.2,s,
C,15,128.1,s,
C,16,123.7,s,
C,17,125.5,s,
C,18,132.0,s,
C,19,76.9,s,
O,20,,,
C,21,63.9,s,
C,22,38.77,s,
C,23,56.1,s,
C,24,74.22,s,
O,25,,,
H,26,1.09,t,7.2
H,27,1.09,t,7.2
H,28,1.09,t,7.2
H,29,2.36,q,7.2
H,30,2.36,q,7.2
H,31,3.49,ddd,"8.6,5.1,3.0"
H,32,2.15,dd,"12.4,5.1"
H,33,2.15,dd,"12.4,3.0"
H,34,3.73,s,
H,35,3.73,s,
H,36,3.73,s,
H,37,7.14,ddd,"7.7,1.4,0.5"
H,38,7.23,ddd,"8.1,7.7,1.4"
H,39,6.94,ddd,"9.4,8.1,1.4"
H,40,7.25,ddd,"9.4,1.4,0.5"
H,41,4.77,d,1.3
H,42,4.04,dd,"9.4,4.7"
H,43,4.04,dd,"9.4,1.9"
H,44,2.27,m,
H,45,2.83,dd,"4.9,1.8"
H,46,4.19,dd,"1.8,1.3"
H,47,,,
