C,1,54.74,s,
O,2,,,
C,3,102.94,s,
O,4,,,
C,5,67.61,s,
C,6,134.87,s,
C,7,141.77,s,
C,8,43.88,s,
C,9,35.03,s,
C,10,28.65,s,
C,11,28.65,s,
C,12,42.11,s,
C,13,42.38,s,
C,14,42.36,s,
C,15,15.05,s,
C,16,75.7,s,
O,17,,,
C,18,35.12,s,
C,19,43.88,s,
H,20,3.32,s,
H,21,3.32,s,
H,22,3.32,s,
H,23,5.23,d,2.3
H,24,4.78,s,
H,25,4.78,s,
H,26,2.32,s,
H,27,2.32,s,
H,28,0.99,s,
H,29,0.99,s,
H,30,0.99,s,
H,31,0.99,s,
H,32,0.99,s,
H,33,0.99,s,
H,34,2.04,dd,"12.4,6.5"
H,35,2.04,dd,"12.7,12.4"
H,36,2.99,ddd,"12.7,6.5,3.8"
H,37,2.01,qdd,"6.6,4.9,3.8"
H,38,0.99,d,6.6
H,39,0.99,d,6.6
H,40,0.99,d,6.6
H,41,3.8,ddd,"8.5,4.9,1.4"
H,42,,,
H,43,1.88,ddd,"12.4,12.2,8.5"
H,44,1.88,ddd,"12.4,3.4,1.4"
H,45,2.83,ddd,"12.2,3.4,2.3"
