C,1,19.08,s,
C,2,33.95,s,
C,3,28.16,s,
C,4,28.16,s,
C,5,47.74,s,
C,6,132.07,s,
C,7,151.21,s,
N,8,,,
C,9,170.73,s,
C,10,41.86,s,
C,11,57.53,s,
N,12,,,
C,13,170.73,s,
C,14,41.86,s,
C,15,,,
O,16,,,
C,17,50.54,s,
C,18,25.2,s,
C,19,32.0,s,
C,20,35.16,s,
C,21,18.52,s,
C,22,40.4,s,
C,23,85.6,s,
O,24,,,
H,25,1.42,d,6.7
H,26,1.42,d,6.7
H,27,1.42,d,6.7
H,28,2.31,qdd,"6.7,4.0,0.4"
H,29,1.58,m,
H,30,1.58,m,
H,31,1.58,m,
H,32,1.58,m,
H,33,2.94,dd,"11.4,7.0"
H,34,8.09,s,
H,35,7.64,s,
H,36,4.28,d,1.7
H,37,7.64,s,
H,38,9.63,s,
H,39,1.61,ddd,"10.2,9.6,8.7"
H,40,1.46,m,
H,41,1.46,m,
H,42,1.45,m,
H,43,1.45,m,
H,44,1.68,m,
H,45,0.92,d,6.5
H,46,0.92,d,6.5
H,47,0.92,d,6.5
H,48,2.83,ddd,"9.8,9.6,1.7"
H,49,4.52,s,
H,50,,,
