C,1,55.5,s,
O,2,,,
C,3,160.8,s,
C,4,115.75,s,
C,5,125.66,s,
C,6,135.9,s,
C,7,124.35,s,
C,8,103.54,s,
C,9,116.6,s,
C,10,141.7,s,
C,11,146.6,s,
C,12,106.1,s,
C,13,127.53,s,
C,14,125.36,s,
C,15,60.72,s,
C,16,36.04,s,
N,17,,,
C,18,170.52,s,
C,19,22.41,s,
O,20,,,
C,21,39.76,s,
C,22,28.2,s,
O,23,,,
C,24,100.2,s,
O,25,,,
H,26,3.77,s,
H,27,3.77,s,
H,28,3.77,s,
H,29,7.01,dd,"7.6,1.9"
H,30,6.87,dd,"7.6,0.5"
H,31,7.33,dd,"1.9,0.5"
H,32,6.68,s,
H,33,4.39,dd,"13.2,4.4"
H,34,2.9,dd,"15.4,13.2"
H,35,2.9,dd,"15.4,4.4"
H,36,1.67,s,
H,37,1.67,s,
H,38,1.67,s,
H,39,4.09,ddd,"13.1,12.4,6.3"
H,40,4.09,ddd,"12.4,6.7,2.2"
H,41,2.85,ddd,"15.4,6.3,2.2"
H,42,2.85,ddd,"15.4,13.1,6.7"
H,43,5.88,s,
H,44,5.88,s,
