O,1,,,
C,2,174.27,s,
C,3,32.99,s,
C,4,19.71,s,
C,5,27.91,s,
C,6,60.6,s,
C,7,33.37,s,
C,8,27.6,s,
C,9,32.05,s,
C,10,47.73,s,
N,11,,,
C,12,65.95,s,
C,13,71.85,s,
O,14,,,
C,15,35.56,s,
C,16,54.85,s,
N,17,,,
C,18,54.18,s,
H,19,2.6,ddd,"15.4,7.6,1.9"
H,20,2.6,ddd,"15.4,11.3,6.7"
H,21,1.66,m,
H,22,1.66,m,
H,23,2.3,m,
H,24,2.3,m,
H,25,3.6,ddd,"9.2,8.1,3.4"
H,26,2.83,m,
H,27,1.83,ddd,"12.4,4.8,1.9"
H,28,1.83,ddd,"12.4,4.1,1.4"
H,29,2.83,m,
H,30,3.31,dd,"12.4,1.8"
H,31,3.31,dd,"12.4,10.4"
H,32,3.18,dd,"2.9,1.6"
H,33,4.36,ddd,"9.5,3.2,2.9"
H,34,,,
H,35,2.0,m,
H,36,2.0,m,
H,37,3.05,ddd,"10.5,9.4,3.3"
H,38,3.05,ddd,"11.2,9.4,6.2"
H,39,3.31,dd,"12.4,6.6"
H,40,3.31,dd,"12.4,9.5"
