C,1,15.47,s,
C,2,55.31,s,
C,3,59.7,s,
C,4,76.96,s,
O,5,,,
C,6,48.02,s,
C,7,43.99,s,
C,8,17.82,s,
C,9,40.4,s,
C,10,136.39,s,
C,11,136.39,s,
C,12,40.4,s,
C,13,43.47,s,
C,14,20.08,s,
C,15,20.08,s,
C,16,71.56,s,
N,17,,,
C,18,44.63,s,
C,19,44.63,s,
C,20,29.71,s,
C,21,35.28,s,
C,22,23.43,s,
C,23,29.97,s,
C,24,23.43,s,
C,25,26.43,s,
C,26,32.64,s,
C,27,43.99,s,
C,28,17.82,s,
N,29,,,
C,30,40.0,s,
C,31,40.0,s,
H,32,1.25,d,6.3
H,33,1.25,d,6.3
H,34,1.25,d,6.3
H,35,3.34,qd,"6.3,5.4"
H,36,2.83,dd,"9.0,5.4"
H,37,4.19,ddd,"9.9,9.0,3.2"
H,38,,,
H,39,2.08,dd,"12.4,9.9"
H,40,2.08,dd,"12.4,3.2"
H,41,1.02,s,
H,42,1.02,s,
H,43,1.02,s,
H,44,2.83,d,2.6
H,45,6.16,dd,"11.0,2.6"
H,46,6.16,dd,"11.0,2.7"
H,47,2.83,d,2.7
H,48,1.13,s,
H,49,1.13,s,
H,50,1.13,s,
H,51,1.13,s,
H,52,1.13,s,
H,53,1.13,s,
H,54,3.78,dd,"12.5,5.5"
H,55,2.38,s,
H,56,2.38,s,
H,57,2.38,s,
H,58,2.38,s,
H,59,2.38,s,
H,60,2.38,s,
H,61,1.84,m,
H,62,1.84,m,
H,63,1.72,ddd,"12.4,4.1,2.4"
H,64,1.72,ddd,"13.8,12.4,3.1"
H,65,0.47,s,
H,66,0.47,s,
H,67,2.25,ddd,"12.4,11.9,6.9"
H,68,2.25,ddd,"12.4,7.7,3.1"
H,69,2.01,ddd,"12.4,11.9,7.7"
H,70,2.01,ddd,"12.4,6.9,3.1"
H,71,1.02,s,
H,72,1.02,s,
H,73,1.02,s,
H,74,2.38,s,
H,75,2.38,s,
H,76,2.38,s,
H,77,2.38,s,
H,78,2.38,s,
H,79,2.38,s,
