C,1,20.72,s,
C,2,170.86,s,
O,3,,,
O,4,,,
C,5,69.15,s,
C,6,57.53,s,
N,7,,,
C,8,162.36,s,
O,9,,,
C,10,57.53,s,
C,11,32.8,s,
C,12,134.98,s,
C,13,129.14,s,
C,14,115.01,s,
C,15,161.0,s,
O,16,,,
C,17,65.38,s,
C,18,119.57,s,
C,19,138.93,s,
C,20,22.13,s,
C,21,22.13,s,
C,22,115.01,s,
C,23,129.14,s,
N,24,,,
C,25,162.36,s,
O,26,,,
H,27,2.1,s,
H,28,2.1,s,
H,29,2.1,s,
H,30,3.82,d,5.8
H,31,3.82,d,5.8
H,32,4.28,t,5.8
H,33,,,
H,34,4.28,t,6.3
H,35,3.5,d,6.3
H,36,3.5,d,6.3
H,37,7.22,ddd,"7.5,1.9,0.5"
H,38,6.85,ddd,"7.5,1.9,0.5"
H,39,4.57,d,7.0
H,40,4.57,d,7.0
H,41,5.6,t,7.0
H,42,1.77,s,
H,43,1.77,s,
H,44,1.77,s,
H,45,1.77,s,
H,46,1.77,s,
H,47,1.77,s,
H,48,6.85,ddd,"8.1,1.9,0.5"
H,49,7.22,ddd,"8.1,1.9,0.5"
H,50,,,
