C,1,23.79,s,
C,2,41.86,s,
C,3,23.79,s,
C,4,114.8,s,
C,5,141.66,s,
N,6,,,
C,7,163.6,s,
O,8,,,
C,9,86.5,s,
O,10,,,
C,11,36.8,s,
C,12,19.1,s,
C,13,45.3,s,
N,14,,,
C,15,169.5,s,
O,16,,,
C,17,59.23,s,
C,18,44.07,s,
C,19,61.74,s,
N,20,,,
C,21,158.6,s,
C,22,112.33,s,
C,23,136.8,s,
C,24,118.57,s,
C,25,124.77,s,
C,26,120.73,s,
C,27,,,
O,28,,,
H,29,1.13,s,
H,30,1.13,s,
H,31,1.13,s,
H,32,1.13,s,
H,33,1.13,s,
H,34,1.13,s,
H,35,6.44,d,11.0
H,36,7.69,d,11.0
H,37,,,
H,38,2.1,ddd,"12.4,12.3,7.5"
H,39,2.1,dd,"12.4,6.7"
H,40,1.94,m,
H,41,1.94,m,
H,42,3.66,ddd,"12.8,12.4,7.4"
H,43,3.66,ddd,"12.4,7.3,0.9"
H,44,4.49,dd,"10.2,8.2"
H,45,2.23,dd,"12.4,10.2"
H,46,2.23,dd,"12.4,8.2"
H,47,,,
H,48,6.77,ddd,"7.1,1.4,0.5"
H,49,7.38,ddd,"7.8,7.1,1.4"
H,50,6.76,ddd,"7.9,7.8,1.4"
H,51,7.53,ddd,"7.9,1.4,0.5"
