C,1,12.99,s,
C,2,41.44,s,
C,3,178.29,s,
O,4,,,
O,5,,,
C,6,77.06,s,
C,7,43.6,s,
C,8,58.5,s,
C,9,19.55,s,
O,10,,,
C,11,69.0,s,
C,12,22.8,s,
C,13,34.06,s,
C,14,60.59,s,
C,15,17.53,s,
O,16,,,
C,17,59.75,s,
C,18,35.12,s,
C,19,45.42,s,
H,20,1.27,d,6.7
H,21,1.27,d,6.7
H,22,1.27,d,6.7
H,23,2.53,qd,"6.7,0.9"
H,24,4.88,ddd,"8.9,4.5,1.0"
H,25,2.27,dd,"12.4,1.0"
H,26,2.27,dd,"12.4,8.9"
H,27,1.38,s,
H,28,1.38,s,
H,29,1.38,s,
H,30,4.09,dd,"8.9,7.3"
H,31,2.27,m,
H,32,2.27,m,
H,33,2.05,ddd,"13.5,12.4,1.8"
H,34,2.05,ddd,"12.4,6.9,2.4"
H,35,1.33,s,
H,36,1.33,s,
H,37,1.33,s,
H,38,3.37,dd,"9.2,4.2"
H,39,1.88,ddd,"12.4,5.5,4.2"
H,40,1.88,ddd,"12.4,9.2,4.2"
H,41,2.29,m,
