C,1,16.3,s,
C,2,39.3,s,
C,3,39.7,s,
C,4,18.3,s,
C,5,34.15,s,
C,6,48.4,s,
C,7,24.3,s,
C,8,,,
O,9,,,
C,10,56.5,s,
C,11,20.4,s,
C,12,41.41,s,
C,13,43.78,s,
C,14,37.76,s,
C,15,43.82,s,
C,16,27.18,s,
C,17,18.8,s,
C,18,56.25,s,
C,19,74.62,s,
C,20,25.92,s,
O,21,,,
C,22,46.67,s,
H,23,1.3,s,
H,24,1.3,s,
H,25,1.3,s,
H,26,1.25,ddd,"12.4,4.2,3.6"
H,27,1.25,ddd,"13.5,12.4,3.6"
H,28,1.63,m,
H,29,1.63,m,
H,30,1.72,ddd,"12.4,10.9,9.0"
H,31,1.72,ddd,"12.4,7.6,1.2"
H,32,1.13,s,
H,33,1.13,s,
H,34,1.13,s,
H,35,9.36,s,
H,36,2.11,dd,"12.2,2.1"
H,37,1.74,m,
H,38,1.74,m,
H,39,1.72,ddd,"12.4,6.6,1.6"
H,40,1.72,ddd,"12.4,11.2,9.2"
H,41,2.09,dd,"12.4,1.9"
H,42,2.09,dd,"12.4,4.3"
H,43,1.63,m,
H,44,1.58,m,
H,45,1.58,m,
H,46,1.7,m,
H,47,1.7,m,
H,48,1.1,dd,"9.9,8.9"
H,49,1.31,s,
H,50,1.31,s,
H,51,1.31,s,
H,52,,,
H,53,2.06,s,
H,54,2.06,s,
