C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,46.86,s,
N,5,,,
C,6,57.53,s,
C,7,35.12,s,
C,8,47.74,s,
C,9,41.86,s,
C,10,72.44,s,
O,11,,,
C,12,170.74,s,
C,13,20.86,s,
O,14,,,
C,15,174.33,s,
O,16,,,
O,17,,,
C,18,52.29,s,
C,19,41.86,s,
C,20,36.62,s,
C,21,67.25,s,
O,22,,,
C,23,106.3,s,
N,24,,,
C,25,142.9,s,
C,26,115.48,s,
C,27,130.88,s,
C,28,122.44,s,
C,29,124.58,s,
C,30,134.28,s,
H,31,1.67,d,7.0
H,32,1.67,d,7.0
H,33,1.67,d,7.0
H,34,5.45,q,7.0
H,35,4.69,s,
H,36,4.69,s,
H,37,,,
H,38,4.28,dd,"3.4,2.9"
H,39,2.05,ddd,"12.4,3.4,3.3"
H,40,2.05,ddd,"12.4,3.1,2.9"
H,41,2.94,dd,"3.3,3.1"
H,42,4.13,s,
H,43,4.13,s,
H,44,2.07,s,
H,45,2.07,s,
H,46,2.07,s,
H,47,3.63,s,
H,48,3.63,s,
H,49,3.63,s,
H,50,2.19,ddd,"8.4,4.3,0.6"
H,51,2.19,ddd,"12.9,8.4,6.5"
H,52,3.95,ddd,"6.5,6.4,0.6"
H,53,3.95,ddd,"12.9,6.4,4.3"
H,54,,,
H,55,7.15,ddd,"7.1,1.4,0.5"
H,56,7.22,ddd,"7.6,7.1,1.4"
H,57,6.94,ddd,"9.3,7.6,1.4"
H,58,7.25,ddd,"9.3,1.4,0.5"
