C,1,52.7,s,
O,2,,,
C,3,166.7,s,
O,4,,,
C,5,134.3,s,
C,6,142.6,s,
C,7,48.31,s,
C,8,38.5,s,
C,9,31.1,s,
C,10,80.4,s,
O,11,,,
C,12,165.4,s,
O,13,,,
C,14,112.3,s,
C,15,138.9,s,
C,16,136.1,s,
C,17,125.9,s,
N,18,,,
C,19,33.5,s,
C,20,138.4,s,
N,21,,,
C,22,88.5,s,
C,23,25.3,s,
C,24,132.3,s,
C,25,133.5,s,
C,26,114.0,s,
O,27,,,
O,28,,,
C,29,141.8,s,
C,30,20.9,s,
C,31,130.07,s,
C,32,78.54,s,
O,33,,,
C,34,168.49,s,
C,35,23.15,s,
O,36,,,
C,37,45.18,s,
C,38,29.5,s,
C,39,20.25,s,
C,40,20.25,s,
H,41,3.73,s,
H,42,3.73,s,
H,43,3.73,s,
H,44,5.92,d,3.0
H,45,3.02,ddd,"7.5,3.2,3.0"
H,46,2.99,ddd,"3.3,3.2,2.4"
H,47,1.88,ddd,"12.4,12.0,3.3"
H,48,1.88,ddd,"12.4,2.4,2.0"
H,49,4.54,dd,"12.0,2.0"
H,50,6.26,d,16.0
H,51,8.72,d,16.0
H,52,7.0,s,
H,53,3.66,s,
H,54,3.66,s,
H,55,3.66,s,
H,56,7.84,s,
H,57,1.24,s,
H,58,1.24,s,
H,59,1.24,s,
H,60,5.99,s,
H,61,6.45,s,
H,62,,,
H,63,1.9,s,
H,64,1.9,s,
H,65,1.9,s,
H,66,5.41,d,2.8
H,67,5.13,dd,"11.7,2.8"
H,68,2.08,s,
H,69,2.08,s,
H,70,2.08,s,
H,71,2.77,ddd,"11.7,7.5,5.5"
H,72,1.87,m,"6.4,5.5"
H,73,0.88,d,6.4
H,74,0.88,d,6.4
H,75,0.88,d,6.4
H,76,0.88,d,6.4
H,77,0.88,d,6.4
H,78,0.88,d,6.4
