C,1,55.95,s,
O,2,,,
C,3,147.7,s,
C,4,111.3,s,
C,5,128.5,s,
C,6,128.6,s,
C,7,109.0,s,
C,8,147.3,s,
O,9,,,
C,10,55.78,s,
C,11,63.1,s,
C,12,38.4,s,
C,13,18.4,s,
C,14,135.1,s,
C,15,124.59,s,
C,16,115.43,s,
C,17,144.25,s,
O,18,,,
C,19,145.43,s,
O,20,,,
C,21,60.98,s,
C,22,122.75,s,
C,23,54.5,s,
N,24,,,
C,25,51.5,s,
C,26,29.4,s,
H,27,3.8,s,
H,28,3.8,s,
H,29,3.8,s,
H,30,6.55,d,0.5
H,31,6.64,d,0.5
H,32,3.8,s,
H,33,3.8,s,
H,34,3.8,s,
H,35,4.83,d,7.9
H,36,3.91,dq,"7.9,6.7"
H,37,1.66,d,6.7
H,38,1.66,d,6.7
H,39,1.66,d,6.7
H,40,7.03,d,7.4
H,41,6.82,d,7.4
H,42,,,
H,43,3.84,s,
H,44,3.84,s,
H,45,3.84,s,
H,46,4.25,s,
H,47,4.25,s,
H,48,3.29,ddd,"13.3,12.4,4.1"
H,49,3.29,ddd,"12.4,4.8,2.0"
H,50,3.09,ddd,"15.4,13.3,4.8"
H,51,3.09,ddd,"15.4,4.1,2.0"
