C,1,14.38,s,
C,2,129.85,s,
C,3,145.17,s,
C,4,63.31,s,
O,5,,,
C,6,41.63,s,
C,7,29.33,s,
C,8,51.96,s,
N,9,,,
C,10,52.65,s,
C,11,21.91,s,
C,12,107.48,s,
C,13,134.37,s,
N,14,,,
C,15,136.01,s,
C,16,110.86,s,
C,17,121.27,s,
C,18,119.48,s,
C,19,118.0,s,
C,20,127.42,s,
C,21,58.93,s,
C,22,30.6,s,
H,23,1.83,d,7.0
H,24,1.83,d,7.0
H,25,1.83,d,7.0
H,26,6.26,q,7.0
H,27,4.66,s,
H,28,4.66,s,
H,29,,,
H,30,2.85,m,
H,31,1.8,m,
H,32,1.8,m,
H,33,3.34,ddd,"12.4,11.2,7.2"
H,34,3.34,ddd,"12.4,6.8,1.5"
H,35,3.04,ddd,"12.4,6.0,2.5"
H,36,3.04,ddd,"12.7,12.4,4.8"
H,37,2.62,ddd,"15.4,4.8,2.5"
H,38,2.62,ddd,"15.4,12.7,6.0"
H,39,,,
H,40,7.32,ddd,"8.1,1.4,0.5"
H,41,7.18,ddd,"8.1,6.6,1.4"
H,42,7.13,ddd,"7.0,6.6,1.4"
H,43,7.48,ddd,"7.0,1.4,0.5"
H,44,4.6,dd,"9.4,1.0"
H,45,1.87,ddd,"12.4,1.3,1.0"
H,46,1.87,ddd,"12.4,11.2,9.4"
