C,1,19.21,s,
C,2,71.42,s,
O,3,,,
C,4,153.07,s,
C,5,115.1,s,
C,6,105.26,s,
C,7,139.8,s,
N,8,,,
C,9,164.56,s,
O,10,,,
C,11,132.07,s,
C,12,132.07,s,
C,13,190.29,s,
O,14,,,
C,15,41.9,s,
C,16,19.2,s,
C,17,115.75,s,
C,18,127.25,s,
N,19,,,
C,20,138.7,s,
C,21,112.0,s,
C,22,124.6,s,
C,23,120.0,s,
C,24,119.85,s,
C,25,125.35,s,
H,26,1.31,d,6.3
H,27,1.31,d,6.3
H,28,1.31,d,6.3
H,29,4.52,q,6.3
H,30,7.79,s,
H,31,7.23,s,
H,32,9.84,s,
H,33,4.34,ddd,"12.7,12.4,2.6"
H,34,4.34,ddd,"12.9,12.4,4.5"
H,35,3.11,ddd,"15.4,12.9,2.6"
H,36,3.11,ddd,"15.4,12.7,4.5"
H,37,,,
H,38,7.47,ddd,"6.5,1.4,0.5"
H,39,7.18,ddd,"7.0,6.5,1.4"
H,40,7.13,ddd,"8.6,7.0,1.4"
H,41,7.64,ddd,"8.6,1.4,0.5"
