C,1,11.44,s,
C,2,23.66,s,
C,3,38.36,s,
C,4,58.0,s,
N,5,,,
C,6,52.66,s,
C,7,21.72,s,
C,8,106.48,s,
C,9,134.25,s,
N,10,,,
C,11,136.01,s,
C,12,110.86,s,
C,13,121.27,s,
C,14,119.48,s,
C,15,118.0,s,
C,16,127.42,s,
C,17,59.99,s,
C,18,32.07,s,
C,19,42.38,s,
C,20,132.07,s,
C,21,141.72,s,
N,22,,,
C,23,149.93,s,
C,24,110.86,s,
C,25,129.93,s,
C,26,119.9,s,
C,27,122.0,s,
C,28,133.6,s,
C,29,52.77,s,
C,30,42.57,s,
C,31,50.96,s,
N,32,,,
C,33,52.24,s,
C,34,140.6,s,
C,35,127.43,s,
C,36,64.79,s,
O,37,,,
C,38,81.52,s,
C,39,44.0,s,
C,40,31.54,s,
C,41,26.77,s,
C,42,60.23,s,
C,43,61.05,s,
H,44,0.88,t,7.0
H,45,0.88,t,7.0
H,46,0.88,t,7.0
H,47,1.44,qd,"7.0,6.0"
H,48,1.44,qd,"7.0,6.0"
H,49,3.15,m,
H,50,3.31,dd,"12.4,1.2"
H,51,3.31,dd,"12.4,7.2"
H,52,3.05,ddd,"12.4,6.6,1.8"
H,53,3.05,ddd,"12.9,12.4,6.6"
H,54,2.54,ddd,"15.4,6.6,1.8"
H,55,2.54,ddd,"15.4,12.9,6.6"
H,56,,,
H,57,7.32,ddd,"7.0,1.4,0.5"
H,58,7.18,ddd,"7.5,7.0,1.4"
H,59,7.13,ddd,"7.9,7.5,1.4"
H,60,7.48,ddd,"7.9,1.4,0.5"
H,61,4.6,dd,"10.1,8.0"
H,62,2.19,ddd,"12.4,11.5,10.1"
H,63,2.19,ddd,"12.4,8.0,1.4"
H,64,2.99,ddd,"11.5,11.1,1.4"
H,65,7.61,s,
H,66,7.32,ddd,"6.2,1.4,0.5"
H,67,7.43,ddd,"9.0,6.2,1.4"
H,68,7.04,ddd,"9.0,7.4,1.4"
H,69,7.11,ddd,"7.4,1.4,0.5"
H,70,1.85,ddd,"12.4,4.1,1.6"
H,71,1.85,ddd,"13.1,12.4,8.3"
H,72,3.01,ddd,"13.1,9.4,4.1"
H,73,3.01,ddd,"9.4,8.3,1.6"
H,74,3.2,s,
H,75,3.2,s,
H,76,5.88,dd,"5.8,2.7"
H,77,4.13,dd,"13.4,5.8"
H,78,4.13,dd,"13.4,2.7"
H,79,5.21,d,10.5
H,80,1.24,ddd,"10.5,8.4,7.9"
H,81,3.12,ddd,"8.4,4.9,2.3"
H,82,1.88,ddd,"12.4,4.9,2.9"
H,83,1.88,ddd,"12.4,4.0,2.3"
H,84,3.91,dd,"4.0,2.9"
H,85,3.54,d,7.9
