C,1,17.7,s,
C,2,34.2,s,
C,3,17.7,s,
C,4,54.7,s,
N,5,,,
C,6,160.19,s,
O,7,,,
C,8,143.45,s,
C,9,140.72,s,
O,10,,,
C,11,161.6,s,
N,12,,,
C,13,57.53,s,
C,14,30.56,s,
C,15,18.38,s,
C,16,18.38,s,
N,17,,,
C,18,169.0,s,
O,19,,,
C,20,72.7,s,
N,21,,,
C,22,167.6,s,
O,23,,,
C,24,81.9,s,
C,25,21.4,s,
C,26,51.1,s,
C,27,30.4,s,
C,28,17.45,s,
C,29,17.45,s,
N,30,,,
C,31,159.0,s,
O,32,,,
C,33,147.3,s,
C,34,124.9,s,
S,35,,,
C,36,167.5,s,
N,37,,,
H,38,0.88,d,6.4
H,39,0.88,d,6.4
H,40,0.88,d,6.4
H,41,2.09,m,"6.4,5.5"
H,42,0.88,d,6.4
H,43,0.88,d,6.4
H,44,0.88,d,6.4
H,45,4.28,dd,"7.0,5.5"
H,46,7.4,d,7.0
H,47,7.86,s,
H,48,4.28,dd,"7.0,5.5"
H,49,2.09,m,"6.4,5.5"
H,50,0.88,d,6.4
H,51,0.88,d,6.4
H,52,0.88,d,6.4
H,53,0.88,d,6.4
H,54,0.88,d,6.4
H,55,0.88,d,6.4
H,56,7.4,d,7.0
H,57,5.91,d,6.5
H,58,4.92,dq,"6.5,6.1"
H,59,1.3,d,6.1
H,60,1.3,d,6.1
H,61,1.3,d,6.1
H,62,4.84,dd,"7.0,5.5"
H,63,2.1,m,"6.4,5.5"
H,64,0.95,d,6.4
H,65,0.95,d,6.4
H,66,0.95,d,6.4
H,67,0.95,d,6.4
H,68,0.95,d,6.4
H,69,0.95,d,6.4
H,70,7.4,d,7.0
H,71,8.27,s,
