C,1,12.0,s,
C,2,21.5,s,
C,3,59.7,s,
N,4,,,
C,5,65.6,s,
C,6,34.0,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,19,78.41,s,
C,20,21.5,s,
C,21,34.8,s,
C,22,42.0,s,
C,23,63.9,s,
O,24,,,
H,25,0.9,t,7.0
H,26,0.9,t,7.0
H,27,0.9,t,7.0
H,28,1.59,qd,"7.0,5.8"
H,29,1.59,qd,"7.0,5.8"
H,30,3.7,td,"5.8,4.0"
H,31,,,
H,32,3.7,ddd,"7.6,6.5,2.2"
H,33,2.15,dd,"12.4,2.2"
H,34,2.15,dd,"12.4,6.5"
H,35,3.73,s,
H,36,3.73,s,
H,37,3.73,s,
H,38,7.14,ddd,"7.0,1.4,0.5"
H,39,7.23,ddd,"7.7,7.0,1.4"
H,40,6.94,ddd,"9.6,7.7,1.4"
H,41,7.25,ddd,"9.6,1.4,0.5"
H,42,4.77,dd,"7.9,1.0"
H,43,1.88,ddd,"12.4,10.3,7.9"
H,44,1.88,ddd,"12.4,5.0,1.0"
H,45,2.26,dtd,"10.3,5.0,4.0"
H,46,2.27,m,
H,47,4.04,dd,"9.4,1.7"
H,48,4.04,dd,"9.4,3.7"
