C,1,20.79,s,
C,2,169.89,s,
O,3,,,
O,4,,,
C,5,76.9,s,
C,6,75.52,s,
O,7,,,
C,8,171.09,s,
C,9,20.86,s,
O,10,,,
C,11,78.54,s,
O,12,,,
C,13,68.1,s,
C,14,119.2,s,
C,15,140.8,s,
C,16,23.7,s,
C,17,28.0,s,
C,18,20.9,s,
C,19,43.3,s,
C,20,67.18,s,
O,21,,,
C,22,51.85,s,
C,23,14.45,s,
C,24,64.67,s,
C,25,46.35,s,
O,26,,,
H,27,2.0,s,
H,28,2.0,s,
H,29,2.0,s,
H,30,4.77,d,5.6
H,31,4.7,dd,"5.6,4.1"
H,32,2.1,s,
H,33,2.1,s,
H,34,2.1,s,
H,35,4.76,d,4.1
H,36,3.59,d,4.3
H,37,5.43,d,4.3
H,38,1.74,s,
H,39,1.74,s,
H,40,1.74,s,
H,41,2.12,ddd,"15.4,5.7,3.4"
H,42,2.12,ddd,"15.4,13.6,4.2"
H,43,1.96,ddd,"12.4,4.2,3.4"
H,44,1.96,ddd,"13.6,12.4,5.7"
H,45,3.97,s,
H,46,3.97,s,
H,47,,,
H,48,1.03,s,
H,49,1.03,s,
H,50,1.03,s,
H,51,2.73,s,
H,52,2.73,s,
