C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,51.67,s,
N,5,,,
C,6,62.1,s,
C,7,38.34,s,
C,8,41.86,s,
C,9,,,
O,10,,,
C,11,55.2,s,
C,12,42.38,s,
C,13,35.12,s,
C,14,56.75,s,
C,15,57.53,s,
N,16,,,
C,17,35.85,s,
C,18,131.53,s,
C,19,147.9,s,
O,20,,,
C,21,118.5,s,
C,22,128.5,s,
C,23,124.58,s,
C,24,134.28,s,
H,25,1.67,d,7.0
H,26,1.67,d,7.0
H,27,1.67,d,7.0
H,28,5.45,q,7.0
H,29,3.82,s,
H,30,3.82,s,
H,31,3.6,ddd,"7.4,3.6,0.5"
H,32,2.15,dd,"12.4,3.6"
H,33,2.15,dd,"12.4,0.5"
H,34,2.83,dd,"7.4,4.6"
H,35,2.99,ddd,"5.7,4.6,1.3"
H,36,2.05,ddd,"12.4,7.9,1.3"
H,37,2.05,ddd,"12.4,5.7,0.9"
H,38,2.3,ddd,"7.9,0.9,0.8"
H,39,4.28,d,0.8
H,40,3.18,s,
H,41,3.18,s,
H,42,3.18,s,
H,43,,,
H,44,6.95,dd,"8.1,1.4"
H,45,7.3,dd,"8.1,7.9"
H,46,7.25,dd,"7.9,1.4"
