C,1,19.64,s,
C,2,159.7,s,
C,3,125.0,s,
C,4,,,
O,5,,,
C,6,41.86,s,
C,7,35.28,s,
C,8,25.5,s,
C,9,58.08,s,
N,10,,,
C,11,45.14,s,
C,12,49.76,s,
C,13,26.95,s,
C,14,126.29,s,
C,15,167.36,s,
C,16,73.18,s,
O,17,,,
C,18,35.12,s,
C,19,43.45,s,
C,20,33.14,s,
H,21,1.75,s,
H,22,1.75,s,
H,23,1.75,s,
H,24,6.22,s,
H,25,1.72,ddd,"13.1,12.4,0.6"
H,26,1.72,ddd,"12.4,9.7,2.4"
H,27,1.71,m,
H,28,1.71,m,
H,29,2.3,ddd,"12.4,7.8,1.8"
H,30,2.3,dd,"12.4,11.0"
H,31,2.28,s,
H,32,2.28,s,
H,33,2.28,s,
H,34,3.34,dd,"12.4,11.2"
H,35,3.34,ddd,"12.4,10.8,2.6"
H,36,2.4,ddd,"15.4,10.8,4.6"
H,37,2.4,m,
H,38,5.54,dd,"6.4,4.6"
H,39,4.37,dd,"11.2,7.2"
H,40,,,
H,41,1.88,ddd,"12.4,7.2,3.4"
H,42,1.88,ddd,"12.4,12.3,11.2"
H,43,1.61,m,
H,44,2.44,dd,"15.4,7.5"
H,45,2.44,dd,"15.4,1.3"
