C,1,13.51,s,
C,2,125.03,s,
C,3,132.62,s,
C,4,65.8,s,
N,5,,,
C,6,55.74,s,
C,7,62.53,s,
C,8,28.05,s,
C,9,108.8,s,
C,10,143.45,s,
N,11,,,
C,12,137.91,s,
C,13,109.7,s,
C,14,121.0,s,
C,15,121.23,s,
C,16,118.19,s,
C,17,128.61,s,
C,18,57.53,s,
C,19,178.79,s,
O,20,,,
O,21,,,
C,22,40.4,s,
C,23,30.5,s,
C,24,71.6,s,
H,25,1.83,d,7.0
H,26,1.83,d,7.0
H,27,1.83,d,7.0
H,28,6.26,q,7.0
H,29,4.28,s,
H,30,4.28,s,
H,31,3.34,s,
H,32,3.34,s,
H,33,3.34,s,
H,34,3.52,ddd,"12.4,5.6,2.6"
H,35,3.52,ddd,"13.0,12.4,6.8"
H,36,3.01,ddd,"15.4,6.8,2.6"
H,37,3.01,ddd,"15.4,13.0,5.6"
H,38,7.54,ddd,"7.3,1.4,0.5"
H,39,7.43,ddd,"7.6,7.3,1.4"
H,40,7.2,ddd,"7.6,6.3,1.4"
H,41,7.5,ddd,"6.3,1.4,0.5"
H,42,4.28,d,2.3
H,43,3.58,ddd,"5.1,2.3,2.1"
H,44,0.91,ddd,"12.4,5.1,0.2"
H,45,0.91,ddd,"12.4,5.7,2.1"
H,46,4.86,dd,"5.7,0.2"
