C,1,15.61,s,
C,2,139.01,s,
C,3,127.36,s,
C,4,18.81,s,
C,5,167.45,s,
O,6,,,
O,7,,,
C,8,66.91,s,
C,9,27.0,s,
C,10,66.1,s,
C,11,75.4,s,
O,12,,,
C,13,79.1,s,
O,14,,,
C,15,167.45,s,
O,16,,,
C,17,127.36,s,
C,18,18.81,s,
C,19,139.01,s,
C,20,15.61,s,
C,21,62.7,s,
C,22,27.2,s,
N,23,,,
C,24,35.2,s,
H,25,1.9,d,7.0
H,26,1.9,d,7.0
H,27,1.9,d,7.0
H,28,6.46,q,7.0
H,29,1.87,s,
H,30,1.87,s,
H,31,1.87,s,
H,32,5.14,m,
H,33,2.29,ddd,"12.4,9.8,3.8"
H,34,2.29,ddd,"12.4,7.2,2.3"
H,35,3.2,dd,"3.8,2.3"
H,36,4.8,d,7.6
H,37,,,
H,38,5.8,d,7.6
H,39,1.87,s,
H,40,1.87,s,
H,41,1.87,s,
H,42,6.46,q,7.0
H,43,1.9,d,7.0
H,44,1.9,d,7.0
H,45,1.9,d,7.0
H,46,3.43,dd,"4.7,2.4"
H,47,2.34,ddd,"12.4,10.2,4.7"
H,48,2.34,ddd,"12.4,6.6,2.4"
H,49,2.63,s,
H,50,2.63,s,
H,51,2.63,s,
