C,1,52.9,s,
O,2,,,
C,3,170.77,s,
O,4,,,
C,5,60.55,s,
C,6,39.16,s,
S,7,,,
S,8,,,
C,9,39.16,s,
C,10,60.55,s,
C,11,170.77,s,
O,12,,,
O,13,,,
C,14,52.9,s,
N,15,,,
C,16,172.36,s,
O,17,,,
C,18,36.65,s,
C,19,35.38,s,
C,20,15.94,s,
C,21,173.33,s,
O,22,,,
N,23,,,
C,24,172.36,s,
O,25,,,
C,26,36.65,s,
C,27,35.38,s,
C,28,15.94,s,
C,29,173.33,s,
O,30,,,
H,31,3.75,s,
H,32,3.75,s,
H,33,3.75,s,
H,34,3.45,t,6.4
H,35,3.27,d,6.4
H,36,3.27,d,6.4
H,37,3.27,d,6.4
H,38,3.27,d,6.4
H,39,3.45,t,6.4
H,40,3.75,s,
H,41,3.75,s,
H,42,3.75,s,
H,43,2.5,dd,"18.4,7.1"
H,44,2.5,dd,"18.4,11.4"
H,45,3.08,ddq,"11.4,7.1,6.7"
H,46,1.46,d,6.7
H,47,1.46,d,6.7
H,48,1.46,d,6.7
H,49,2.5,dd,"18.4,10.7"
H,50,2.5,dd,"18.4,7.2"
H,51,3.08,ddq,"10.7,7.2,6.7"
H,52,1.46,d,6.7
H,53,1.46,d,6.7
H,54,1.46,d,6.7
