H,1,,,
N,2,,,
C,3,162.36,s,
O,4,,,
C,5,73.63,s,
O,6,,,
C,7,60.62,s,
N,8,,,
C,9,168.5,s,
O,10,,,
C,11,130.66,s,
C,12,20.13,s,
C,13,133.37,s,
C,14,130.9,s,
C,15,131.94,s,
C,16,131.65,s,
C,17,134.35,s,
C,18,131.65,s,
C,19,125.3,s,
C,20,131.19,s,
C,21,139.99,s,
C,22,139.65,s,
C,23,16.68,s,
C,24,133.0,s,
C,25,139.65,s,
C,26,16.68,s,
C,27,133.7,s,
C,28,70.0,s,
N,29,,,
C,30,173.3,s,
C,31,114.3,s,
C,32,125.08,s,
C,33,129.1,s,
C,34,116.4,s,
C,35,111.9,s,
C,36,123.7,s,
N,37,,,
O,38,,,
C,39,74.58,s,
C,40,18.14,s,
C,41,172.21,s,
O,42,,,
O,43,,,
H,44,,,
H,45,4.52,d,5.5
H,46,,,
H,47,4.68,dd,"7.0,5.5"
H,48,7.4,d,7.0
H,49,2.07,s,
H,50,2.07,s,
H,51,2.07,s,
H,52,6.55,d,11.0
H,53,7.04,dd,"13.0,11.0"
H,54,6.39,dd,"13.0,11.0"
H,55,6.56,d,11.0
H,56,6.56,s,
H,57,6.56,s,
H,58,6.56,d,11.0
H,59,6.55,dd,"13.0,11.0"
H,60,6.3,d,13.0
H,61,1.87,s,
H,62,1.87,s,
H,63,1.87,s,
H,64,6.11,s,
H,65,1.99,s,
H,66,1.99,s,
H,67,1.99,s,
H,68,5.73,d,7.0
H,69,4.28,dd,"7.0,2.8"
H,70,6.16,d,12.0
H,71,8.72,d,12.0
H,72,7.31,dd,"4.7,1.4"
H,73,6.33,dd,"4.7,3.1"
H,74,6.94,dd,"3.1,1.4"
H,75,,,
H,76,4.92,qd,"6.1,2.8"
H,77,1.3,d,6.1
H,78,1.3,d,6.1
H,79,1.3,d,6.1
H,80,,,
