C,1,56.49,s,
O,2,,,
C,3,74.63,s,
C,4,33.8,s,
C,5,126.29,s,
C,6,147.5,s,
C,7,27.4,s,
C,8,46.6,s,
N,9,,,
C,10,40.6,s,
C,11,30.55,s,
C,12,128.38,s,
C,13,109.5,s,
C,14,147.2,s,
C,15,146.3,s,
C,16,110.12,s,
C,17,138.43,s,
C,18,63.9,s,
C,19,43.68,s,
O,20,,,
C,21,101.1,s,
O,22,,,
H,23,3.22,s,
H,24,3.22,s,
H,25,3.22,s,
H,26,4.73,m,
H,27,2.44,ddd,"15.4,9.9,3.0"
H,28,2.44,ddd,"15.4,6.7,4.6"
H,29,5.54,dd,"4.6,3.0"
H,30,2.47,ddd,"12.4,12.0,8.2"
H,31,2.47,ddd,"12.4,7.7,0.5"
H,32,2.89,ddd,"12.0,9.4,7.7"
H,33,2.89,ddd,"9.4,8.2,0.5"
H,34,3.39,ddd,"12.4,6.4,1.7"
H,35,3.39,ddd,"12.4,12.2,7.3"
H,36,2.9,ddd,"15.4,7.3,1.7"
H,37,2.9,ddd,"15.4,12.2,6.4"
H,38,6.58,d,0.5
H,39,6.47,d,0.5
H,40,2.42,dd,"12.4,3.0"
H,41,2.42,dd,"12.4,11.8"
H,42,5.88,s,
H,43,5.88,s,
