C,1,54.7,s,
O,2,,,
C,3,152.3,s,
C,4,95.8,s,
C,5,131.07,s,
C,6,132.07,s,
C,7,71.6,s,
C,8,31.68,s,
C,9,138.21,s,
C,10,125.66,s,
C,11,111.24,s,
C,12,150.42,s,
O,13,,,
C,14,56.02,s,
C,15,145.43,s,
C,16,131.53,s,
C,17,41.86,s,
C,18,36.49,s,
C,19,66.54,s,
N,20,,,
C,21,58.89,s,
O,22,,,
C,23,89.0,s,
O,24,,,
H,25,3.67,s,
H,26,3.67,s,
H,27,3.67,s,
H,28,6.73,d,6.3
H,29,6.88,d,6.3
H,30,4.86,dd,"9.6,0.6"
H,31,3.45,dd,"15.4,0.6"
H,32,3.45,dd,"15.4,9.6"
H,33,6.87,d,8.4
H,34,6.62,d,8.4
H,35,3.87,s,
H,36,3.87,s,
H,37,3.87,s,
H,38,2.37,ddd,"12.4,10.2,2.2"
H,39,2.37,ddd,"12.4,11.0,6.4"
H,40,3.65,ddd,"12.4,11.0,2.2"
H,41,3.65,ddd,"12.4,10.2,6.4"
H,42,3.14,s,
H,43,3.14,s,
H,44,3.14,s,
H,45,4.52,s,
