C,1,27.39,s,
C,2,33.69,s,
C,3,27.39,s,
C,4,42.83,s,
C,5,75.84,s,
O,6,,,
C,7,42.24,s,
C,8,16.14,s,
C,9,42.83,s,
C,10,62.3,s,
O,11,,,
C,12,60.59,s,
C,13,17.53,s,
C,14,34.06,s,
C,15,22.8,s,
C,16,60.4,s,
O,17,,,
C,18,60.6,s,
C,19,18.4,s,
C,20,35.25,s,
C,21,28.16,s,
C,22,51.21,s,
H,23,1.0,s,
H,24,1.0,s,
H,25,1.0,s,
H,26,1.0,s,
H,27,1.0,s,
H,28,1.0,s,
H,29,2.1,dd,"12.4,1.3"
H,30,2.1,dd,"12.4,6.7"
H,31,4.12,dd,"6.7,1.3"
H,32,,,
H,33,1.13,s,
H,34,1.13,s,
H,35,1.13,s,
H,36,2.1,dd,"12.4,9.2"
H,37,2.1,dd,"12.4,3.0"
H,38,2.85,dd,"9.2,3.0"
H,39,1.33,s,
H,40,1.33,s,
H,41,1.33,s,
H,42,2.05,ddd,"12.4,11.5,1.9"
H,43,2.05,ddd,"12.4,11.7,7.8"
H,44,2.27,m,
H,45,2.27,m,
H,46,4.09,dd,"10.8,2.2"
H,47,1.43,s,
H,48,1.43,s,
H,49,1.43,s,
H,50,1.81,ddd,"13.7,12.4,1.9"
H,51,1.81,ddd,"12.4,8.9,1.6"
H,52,1.58,m,
H,53,1.58,m,
H,54,1.45,dd,"5.9,1.1"
