C,1,29.9,s,
C,2,31.3,s,
C,3,29.9,s,
C,4,39.4,s,
C,5,28.16,s,
C,6,38.19,s,
C,7,62.1,s,
C,8,29.58,s,
C,9,21.3,s,
C,10,55.33,s,
N,11,,,
C,12,55.9,s,
C,13,73.63,s,
O,14,,,
C,15,59.0,s,
C,16,46.67,s,
H,17,0.97,s,
H,18,0.97,s,
H,19,0.97,s,
H,20,0.97,s,
H,21,0.97,s,
H,22,0.97,s,
H,23,1.31,ddd,"12.4,10.2,1.6"
H,24,1.31,ddd,"12.4,10.5,8.5"
H,25,1.58,m,
H,26,1.58,m,
H,27,5.28,ddd,"12.2,7.8,6.2"
H,28,3.6,ddd,"11.8,7.8,4.2"
H,29,1.75,m,
H,30,1.75,m,
H,31,1.9,m,
H,32,1.9,m,
H,33,2.92,ddd,"9.4,9.1,2.3"
H,34,2.92,ddd,"10.7,9.4,9.1"
H,35,3.69,dd,"12.4,5.5"
H,36,3.69,d,12.4
H,37,4.52,d,5.5
H,38,2.06,s,
H,39,2.06,s,
