C,1,21.24,s,
C,2,170.18,s,
O,3,,,
O,4,,,
C,5,78.41,s,
C,6,32.48,s,
C,7,142.11,s,
C,8,143.15,s,
C,9,25.94,s,
C,10,28.16,s,
C,11,46.61,s,
C,12,139.41,s,
C,13,133.0,s,
C,14,132.53,s,
C,15,120.34,s,
C,16,165.67,s,
O,17,,,
O,18,,,
C,19,81.82,s,
C,20,25.61,s,
C,21,25.61,s,
C,22,44.35,s,
C,23,24.38,s,
C,24,32.49,s,
C,25,27.73,s,
C,26,50.54,s,
C,27,39.3,s,
C,28,13.55,s,
C,29,79.9,s,
C,30,23.65,s,
C,31,139.0,s,
C,32,128.45,s,
C,33,16.9,s,
C,34,166.2,s,
O,35,,,
O,36,,,
C,37,47.72,s,
C,38,17.01,s,
H,39,2.01,s,
H,40,2.01,s,
H,41,2.01,s,
H,42,4.77,dd,"7.4,1.5"
H,43,2.56,dd,"15.4,1.5"
H,44,2.56,dd,"15.4,7.4"
H,45,2.37,ddd,"13.4,6.4,2.9"
H,46,2.37,ddd,"13.8,13.4,2.2"
H,47,1.58,m,
H,48,1.58,m,
H,49,2.6,dd,"8.6,1.4"
H,50,6.16,s,
H,51,6.58,d,13.0
H,52,5.79,d,13.0
H,53,1.34,s,
H,54,1.34,s,
H,55,1.34,s,
H,56,1.34,s,
H,57,1.34,s,
H,58,1.34,s,
H,59,1.26,s,
H,60,1.26,s,
H,61,1.26,s,
H,62,1.83,ddd,"12.4,11.8,3.2"
H,63,1.83,ddd,"12.4,11.7,6.0"
H,64,1.72,m,
H,65,1.72,m,
H,66,1.61,ddd,"10.9,8.4,5.6"
H,67,2.11,qdd,"6.6,5.6,5.1"
H,68,1.05,d,6.6
H,69,1.05,d,6.6
H,70,1.05,d,6.6
H,71,4.53,ddd,"10.0,5.1,2.1"
H,72,2.41,ddd,"15.4,4.6,2.1"
H,73,2.41,ddd,"15.4,10.0,3.1"
H,74,6.63,dd,"4.6,3.1"
H,75,1.93,s,
H,76,1.93,s,
H,77,1.93,s,
H,78,1.25,s,
H,79,1.25,s,
H,80,1.25,s,
