C,1,16.19,s,
C,2,128.72,s,
C,3,133.7,s,
C,4,61.6,s,
C,5,31.0,s,
C,6,18.45,s,
C,7,18.45,s,
N,8,,,
C,9,31.45,s,
C,10,169.5,s,
O,11,,,
C,12,57.53,s,
N,13,,,
C,14,162.36,s,
O,15,,,
C,16,57.53,s,
N,17,,,
C,18,42.3,s,
C,19,54.35,s,
C,20,143.45,s,
C,21,136.1,s,
C,22,127.21,s,
C,23,119.55,s,
C,24,120.32,s,
C,25,121.43,s,
C,26,109.13,s,
C,27,136.35,s,
N,28,,,
C,29,30.73,s,
C,30,42.6,s,
C,31,26.6,s,
C,32,26.6,s,
C,33,35.25,s,
C,34,26.47,s,
C,35,26.47,s,
C,36,26.47,s,
C,37,172.79,s,
O,38,,,
O,39,,,
H,40,1.9,s,
H,41,1.9,s,
H,42,1.9,s,
H,43,5.73,d,7.0
H,44,4.56,dd,"7.0,5.7"
H,45,2.09,m,"6.4,5.7"
H,46,0.88,d,6.4
H,47,0.88,d,6.4
H,48,0.88,d,6.4
H,49,0.88,d,6.4
H,50,0.88,d,6.4
H,51,0.88,d,6.4
H,52,2.91,s,
H,53,2.91,s,
H,54,2.91,s,
H,55,4.28,s,
H,56,,,
H,57,4.28,s,
H,58,2.35,s,
H,59,2.35,s,
H,60,2.35,s,
H,61,4.05,s,
H,62,4.05,s,
H,63,8.02,ddd,"6.4,1.4,0.5"
H,64,7.15,ddd,"8.6,6.4,1.4"
H,65,7.97,ddd,"8.6,7.8,1.4"
H,66,7.18,ddd,"7.8,1.4,0.5"
H,67,3.38,s,
H,68,3.38,s,
H,69,3.38,s,
H,70,1.31,s,
H,71,1.31,s,
H,72,1.31,s,
H,73,1.31,s,
H,74,1.31,s,
H,75,1.31,s,
H,76,0.93,s,
H,77,0.93,s,
H,78,0.93,s,
H,79,0.93,s,
H,80,0.93,s,
H,81,0.93,s,
H,82,0.93,s,
H,83,0.93,s,
H,84,0.93,s,
H,85,,,
