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,
O,20,,,
C,21,66.19,s,
O,22,,,
C,23,77.48,s,
C,24,25.81,s,
O,25,,,
C,26,75.5,s,
H,27,0.88,d,6.4
H,28,0.88,d,6.4
H,29,0.88,d,6.4
H,30,1.87,m,"6.4,5.7"
H,31,0.88,d,6.4
H,32,0.88,d,6.4
H,33,0.88,d,6.4
H,34,3.18,d,5.7
H,35,5.43,ddd,"6.2,1.7,1.2"
H,36,2.03,m,
H,37,2.03,m,
H,38,3.16,ddd,"11.2,9.4,4.9"
H,39,3.16,ddd,"11.3,9.4,7.6"
H,40,3.72,dd,"9.4,2.6"
H,41,3.72,dd,"9.4,5.3"
H,42,5.99,dd,"5.3,2.6"
H,43,4.63,s,
H,44,4.63,s,
H,45,,,
H,46,3.92,s,
H,47,3.92,s,
H,48,,,
H,49,1.4,s,
H,50,1.4,s,
H,51,1.4,s,
H,52,,,
H,53,4.38,d,1.7
