C,1,20.29,s,
C,2,29.4,s,
C,3,20.29,s,
C,4,57.37,s,
C,5,172.96,s,
O,6,,,
O,7,,,
C,8,74.77,s,
C,9,34.43,s,
C,10,53.65,s,
N,11,,,
C,12,62.9,s,
C,13,128.4,s,
C,14,131.7,s,
C,15,62.66,s,
O,16,,,
C,17,172.75,s,
O,18,,,
C,19,77.48,s,
C,20,25.81,s,
O,21,,,
C,22,77.48,s,
C,23,25.81,s,
O,24,,,
C,25,75.5,s,
H,26,0.88,d,6.4
H,27,0.88,d,6.4
H,28,0.88,d,6.4
H,29,1.87,m,"6.4,5.7"
H,30,0.88,d,6.4
H,31,0.88,d,6.4
H,32,0.88,d,6.4
H,33,3.18,d,5.7
H,34,5.43,ddd,"9.2,8.6,5.7"
H,35,2.03,m,
H,36,2.03,m,
H,37,3.16,ddd,"10.6,9.4,2.6"
H,38,3.16,ddd,"10.3,9.4,7.5"
H,39,3.72,dd,"9.4,4.8"
H,40,3.72,dd,"9.4,2.6"
H,41,5.99,dd,"4.8,2.6"
H,42,4.63,s,
H,43,4.63,s,
H,44,1.47,s,
H,45,1.47,s,
H,46,1.47,s,
H,47,,,
H,48,1.4,s,
H,49,1.4,s,
H,50,1.4,s,
H,51,,,
H,52,4.38,d,5.7
