C,1,56.02,s,
O,2,,,
C,3,150.42,s,
C,4,119.9,s,
C,5,123.56,s,
C,6,133.41,s,
C,7,144.07,s,
O,8,,,
C,9,145.66,s,
N,10,,,
C,11,165.65,s,
O,12,,,
C,13,114.8,s,
C,14,145.43,s,
O,15,,,
C,16,60.98,s,
C,17,41.9,s,
C,18,28.22,s,
C,19,131.87,s,
C,20,110.47,s,
C,21,147.78,s,
C,22,147.29,s,
C,23,110.34,s,
C,24,128.65,s,
O,25,,,
C,26,101.24,s,
O,27,,,
H,28,3.87,s,
H,29,3.87,s,
H,30,3.87,s,
H,31,6.84,d,9.6
H,32,7.56,d,9.6
H,33,,,
H,34,4.1,s,
H,35,4.1,s,
H,36,4.1,s,
H,37,4.34,ddd,"12.4,11.8,7.1"
H,38,4.34,ddd,"12.4,12.2,1.6"
H,39,3.03,ddd,"15.4,11.8,1.6"
H,40,3.03,ddd,"15.4,12.2,7.1"
H,41,6.68,d,0.5
H,42,6.94,d,0.5
H,43,6.12,s,
H,44,6.12,s,
