C,1,14.5,s,
C,2,43.9,s,
C,3,53.83,s,
N,4,,,
C,5,53.21,s,
C,6,23.85,s,
C,7,30.26,s,
C,8,38.61,s,
C,9,30.2,s,
C,10,27.1,s,
C,11,29.1,s,
C,12,27.1,s,
C,13,28.16,s,
C,14,53.09,s,
C,15,,,
O,16,,,
C,17,43.9,s,
C,18,14.5,s,
C,19,53.83,s,
N,20,,,
C,21,53.21,s,
C,22,23.85,s,
C,23,30.26,s,
C,24,38.61,s,
C,25,30.2,s,
C,26,27.1,s,
C,27,29.1,s,
C,28,27.1,s,
C,29,28.16,s,
C,30,53.09,s,
C,31,,,
O,32,,,
C,33,60.03,s,
C,34,60.03,s,
H,35,0.89,d,6.6
H,36,0.89,d,6.6
H,37,0.89,d,6.6
H,38,4.42,qdd,"6.6,6.4,1.1"
H,39,2.96,dd,"12.4,1.1"
H,40,3.31,dd,"12.4,6.4"
H,41,3.4,ddd,"12.7,12.4,3.5"
H,42,3.03,ddd,"12.4,2.8,2.0"
H,43,1.87,m,
H,44,1.75,m,
H,45,1.47,m,
H,46,1.47,m,
H,47,2.0,m,
H,48,1.47,m,
H,49,2.0,m,
H,50,1.47,m,
H,51,1.47,m,
H,52,1.47,m,
H,53,1.47,m,
H,54,1.47,m,
H,55,1.47,m,
H,56,2.0,dtd,"12.8,12.4,8.0"
H,57,2.0,m,
H,58,2.25,ddd,"12.4,9.1,5.8"
H,59,2.25,ddq,"10.8,7.2,6.6"
H,60,1.12,d,6.6
H,61,1.12,d,6.6
H,62,1.12,d,6.6
H,63,3.0,dd,"12.4,7.2"
H,64,3.0,dd,"12.4,10.8"
H,65,3.0,ddd,"12.6,12.4,4.0"
H,66,3.0,ddd,"12.4,7.4,2.1"
H,67,1.87,m,
H,68,1.64,m,
H,69,1.31,m,
H,70,1.31,m,
H,71,1.47,m,
H,72,1.47,m,
H,73,1.47,m,
H,74,1.47,m,
H,75,1.47,m,
H,76,1.47,m,
H,77,1.47,m,
H,78,1.47,m,
H,79,1.47,m,
H,80,2.0,m,
H,81,0.99,m,
H,82,1.83,ddd,"6.6,6.1,0.4"
H,83,1.47,dd,"10.7,6.1"
H,84,2.86,dd,"9.1,3.4"
