C,1,52.65,s,
O,2,,,
C,3,174.79,s,
O,4,,,
C,5,48.55,s,
C,6,42.11,s,
C,7,38.36,s,
C,8,53.83,s,
N,9,,,
C,10,53.93,s,
C,11,21.17,s,
C,12,110.2,s,
C,13,134.91,s,
N,14,,,
C,15,134.7,s,
C,16,110.2,s,
C,17,121.3,s,
C,18,118.9,s,
C,19,117.7,s,
C,20,128.4,s,
C,21,64.27,s,
C,22,36.24,s,
C,23,45.42,s,
C,24,69.6,s,
C,25,20.7,s,
O,26,,,
H,27,3.54,s,
H,28,3.54,s,
H,29,3.54,s,
H,30,2.04,dd,"12.4,1.5"
H,31,2.04,dd,"12.4,3.7"
H,32,3.15,m,
H,33,3.31,dd,"12.4,0.8"
H,34,3.31,dd,"12.4,5.6"
H,35,3.34,ddd,"12.4,6.8,1.8"
H,36,3.34,ddd,"12.5,12.4,6.5"
H,37,3.15,ddd,"13.4,12.5,6.8"
H,38,3.15,ddd,"13.4,6.5,1.8"
H,39,,,
H,40,7.35,ddd,"7.2,1.4,0.5"
H,41,7.18,ddd,"7.3,7.2,1.4"
H,42,7.13,ddd,"7.7,7.3,1.4"
H,43,7.52,ddd,"7.7,1.4,0.5"
H,44,3.78,dd,"4.7,1.2"
H,45,1.87,ddd,"12.4,10.1,1.2"
H,46,1.87,ddd,"12.4,4.7,3.8"
H,47,2.29,m,
H,48,3.98,qd,"6.1,5.0"
H,49,1.2,d,6.1
H,50,1.2,d,6.1
H,51,1.2,d,6.1
H,52,,,
