C,1,56.02,s,
O,2,,,
C,3,150.42,s,
C,4,111.24,s,
C,5,125.66,s,
C,6,138.21,s,
C,7,114.8,s,
C,8,145.43,s,
O,9,,,
C,10,60.98,s,
C,11,165.65,s,
O,12,,,
N,13,,,
C,14,39.76,s,
C,15,27.75,s,
C,16,126.18,s,
C,17,108.2,s,
C,18,145.8,s,
C,19,145.4,s,
C,20,110.33,s,
C,21,129.67,s,
C,22,60.72,s,
C,23,36.04,s,
O,24,,,
C,25,100.8,s,
O,26,,,
H,27,3.87,s,
H,28,3.87,s,
H,29,3.87,s,
H,30,6.62,d,7.2
H,31,6.87,d,7.2
H,32,4.1,s,
H,33,4.1,s,
H,34,4.1,s,
H,35,4.09,ddd,"12.4,9.7,8.8"
H,36,4.09,ddd,"12.4,9.7,1.6"
H,37,2.73,ddd,"15.4,9.7,8.8"
H,38,2.73,ddd,"15.4,9.7,1.6"
H,39,6.57,d,0.5
H,40,6.72,d,0.5
H,41,4.39,dd,"13.4,2.4"
H,42,2.9,dd,"15.4,2.4"
H,43,2.9,dd,"15.4,13.4"
H,44,5.88,s,
H,45,5.88,s,
