C,1,51.7,s,
O,2,,,
C,3,168.25,s,
O,4,,,
C,5,113.97,s,
C,6,130.62,s,
C,7,120.85,s,
C,8,132.76,s,
C,9,124.0,s,
C,10,145.91,s,
N,11,,,
C,12,162.36,s,
O,13,,,
C,14,57.53,s,
C,15,30.69,s,
C,16,29.86,s,
S,17,,,
C,18,15.0,s,
N,19,,,
C,20,162.36,s,
O,21,,,
C,22,143.45,s,
C,23,137.78,s,
N,24,,,
C,25,146.63,s,
C,26,126.6,s,
N,27,,,
C,28,159.73,s,
O,29,,,
N,30,,,
C,31,28.9,s,
C,32,150.4,s,
O,33,,,
N,34,,,
C,35,29.3,s,
H,36,3.8,s,
H,37,3.8,s,
H,38,3.8,s,
H,39,7.87,ddd,"6.8,1.4,0.5"
H,40,7.11,ddd,"8.7,6.8,1.4"
H,41,7.51,ddd,"8.7,6.5,1.4"
H,42,7.48,ddd,"6.5,1.4,0.5"
H,43,,,
H,44,4.28,t,6.1
H,45,2.09,td,"6.6,6.1"
H,46,2.09,td,"6.6,6.1"
H,47,2.54,t,6.6
H,48,2.54,t,6.6
H,49,2.04,s,
H,50,2.04,s,
H,51,2.04,s,
H,52,,,
H,53,8.78,s,
H,54,3.38,s,
H,55,3.38,s,
H,56,3.38,s,
H,57,3.42,s,
H,58,3.42,s,
H,59,3.42,s,
