C,1,15.28,s,
C,2,123.65,s,
C,3,131.0,s,
C,4,27.03,s,
C,5,28.84,s,
C,6,24.46,s,
C,7,42.9,s,
C,8,,,
O,9,,,
C,10,49.3,s,
C,11,7.3,s,
C,12,173.33,s,
O,13,,,
N,14,,,
C,15,141.66,s,
C,16,108.99,s,
C,17,26.85,s,
C,18,49.76,s,
H,19,1.62,d,7.0
H,20,1.62,d,7.0
H,21,1.62,d,7.0
H,22,5.42,dq,"15.0,7.0"
H,23,5.36,dt,"15.0,7.0"
H,24,2.01,dt,"7.0,6.8"
H,25,2.01,dt,"7.0,6.8"
H,26,1.38,tt,"6.8,6.6"
H,27,1.38,tt,"6.8,6.6"
H,28,1.64,tt,"6.7,6.6"
H,29,1.64,tt,"6.7,6.6"
H,30,2.44,t,6.7
H,31,2.44,t,6.7
H,32,2.83,q,6.8
H,33,1.03,d,6.8
H,34,1.03,d,6.8
H,35,1.03,d,6.8
H,36,7.69,d,7.4
H,37,5.21,ddd,"7.4,5.3,2.6"
H,38,2.4,m,
H,39,2.4,m,
H,40,3.34,ddd,"13.8,12.4,6.3"
H,41,3.34,ddd,"12.4,5.7,0.3"
