C,1,8.66,s,
C,2,29.54,s,
C,3,41.86,s,
C,4,35.28,s,
C,5,23.33,s,
C,6,43.29,s,
N,7,,,
C,8,87.49,s,
C,9,132.07,s,
C,10,115.36,s,
C,11,167.0,s,
O,12,,,
O,13,,,
C,14,51.3,s,
C,15,121.51,s,
C,16,123.51,s,
C,17,121.82,s,
C,18,131.17,s,
C,19,116.11,s,
C,20,142.35,s,
N,21,,,
C,22,172.36,s,
O,23,,,
C,24,31.95,s,
C,25,35.28,s,
H,26,0.77,t,7.1
H,27,0.77,t,7.1
H,28,0.77,t,7.1
H,29,1.63,q,7.1
H,30,1.63,q,7.1
H,31,1.72,ddd,"12.4,11.0,8.5"
H,32,1.72,ddd,"12.4,5.7,0.6"
H,33,1.71,m,
H,34,1.71,m,
H,35,3.11,ddd,"12.4,6.6,2.4"
H,36,3.11,ddd,"13.2,12.4,6.0"
H,37,,,
H,38,5.96,s,
H,39,3.7,s,
H,40,3.7,s,
H,41,3.7,s,
H,42,7.83,ddd,"7.6,1.4,0.5"
H,43,7.22,ddd,"7.6,7.3,1.4"
H,44,7.43,ddd,"7.3,6.1,1.4"
H,45,7.32,ddd,"6.1,1.4,0.5"
H,46,2.39,ddd,"15.4,12.3,3.4"
H,47,2.39,ddd,"15.4,12.2,3.3"
H,48,1.72,ddd,"12.4,12.2,3.4"
H,49,1.72,ddd,"12.4,12.3,3.3"
