C,1,12.73,s,
C,2,120.68,s,
C,3,140.47,s,
C,4,46.4,s,
N,5,,,
C,6,86.51,s,
C,7,39.63,s,
C,8,41.86,s,
C,9,134.28,s,
C,10,113.85,s,
C,11,155.15,s,
O,12,,,
C,13,55.88,s,
C,14,114.32,s,
C,15,116.35,s,
C,16,142.35,s,
N,17,,,
C,18,37.35,s,
C,19,92.26,s,
O,20,,,
C,21,52.0,s,
C,22,35.12,s,
C,23,47.74,s,
C,24,41.86,s,
C,25,72.44,s,
O,26,,,
C,27,166.29,s,
O,28,,,
C,29,125.91,s,
C,30,107.12,s,
C,31,152.78,s,
O,32,,,
C,33,56.13,s,
C,34,142.38,s,
O,35,,,
C,36,60.79,s,
C,37,152.78,s,
O,38,,,
C,39,56.13,s,
C,40,107.12,s,
C,41,174.33,s,
O,42,,,
O,43,,,
C,44,52.29,s,
H,45,1.6,d,7.0
H,46,1.6,d,7.0
H,47,1.6,d,7.0
H,48,5.5,q,7.0
H,49,3.82,s,
H,50,3.82,s,
H,51,6.07,dd,"5.0,1.2"
H,52,2.05,dd,"12.4,5.0"
H,53,2.05,dd,"12.4,1.2"
H,54,7.01,dd,"1.9,0.5"
H,55,3.77,s,
H,56,3.77,s,
H,57,3.77,s,
H,58,7.0,dd,"8.1,1.9"
H,59,7.26,dd,"8.1,0.5"
H,60,2.58,s,
H,61,2.58,s,
H,62,2.58,s,
H,63,4.28,dd,"3.0,1.6"
H,64,2.05,ddd,"12.4,4.8,1.6"
H,65,2.05,ddd,"12.4,3.0,2.9"
H,66,2.94,dd,"4.8,2.9"
H,67,4.13,s,
H,68,4.13,s,
H,69,7.27,s,
H,70,3.87,s,
H,71,3.87,s,
H,72,3.87,s,
H,73,3.85,s,
H,74,3.85,s,
H,75,3.85,s,
H,76,3.87,s,
H,77,3.87,s,
H,78,3.87,s,
H,79,7.27,s,
H,80,3.63,s,
H,81,3.63,s,
H,82,3.63,s,
