C,1,15.09,s,
C,2,35.06,s,
C,3,34.22,s,
C,4,82.83,s,
C,5,63.51,s,
C,6,26.69,s,
C,7,27.02,s,
C,8,71.13,s,
N,9,,,
C,10,46.07,s,
C,11,22.39,s,
C,12,26.63,s,
C,13,27.16,s,
C,14,90.53,s,
O,15,,,
C,16,176.13,s,
O,17,,,
C,18,41.21,s,
C,19,12.69,s,
C,20,78.79,s,
O,21,,,
O,22,,,
C,23,179.59,s,
O,24,,,
H,25,1.2,d,6.7
H,26,1.2,d,6.7
H,27,1.2,d,6.7
H,28,2.59,qdd,"6.7,6.0,0.6"
H,29,1.79,ddd,"12.4,1.7,0.6"
H,30,1.79,ddd,"12.4,10.7,6.0"
H,31,4.18,ddd,"10.7,4.9,1.7"
H,32,3.45,ddd,"9.7,4.9,3.2"
H,33,1.58,m,
H,34,1.58,m,
H,35,2.1,m,
H,36,2.1,m,
H,37,3.64,dd,"12.1,4.5"
H,38,3.38,ddd,"13.1,12.4,4.6"
H,39,3.38,ddd,"12.4,4.5,1.7"
H,40,1.49,m,
H,41,1.49,m,
H,42,1.41,m,
H,43,1.41,m,
H,44,2.12,ddd,"12.4,9.1,1.2"
H,45,2.12,ddd,"12.4,9.8,1.2"
H,46,2.87,dq,"9.2,6.7"
H,47,1.36,d,6.7
H,48,1.36,d,6.7
H,49,1.36,d,6.7
H,50,4.09,d,9.2
H,51,,,
