C,1,12.8,s,
C,2,43.2,s,
C,3,64.4,s,
O,4,,,
C,5,176.1,s,
O,6,,,
O,7,,,
C,8,64.4,s,
C,9,74.9,s,
O,10,,,
C,11,101.42,s,
O,12,,,
C,13,151.21,s,
C,14,117.22,s,
C,15,116.96,s,
C,16,152.86,s,
O,17,,,
C,18,116.96,s,
C,19,117.22,s,
C,20,74.16,s,
O,21,,,
C,22,76.8,s,
O,23,,,
C,24,70.7,s,
O,25,,,
H,26,1.03,d,6.7
H,27,1.03,d,6.7
H,28,1.03,d,6.7
H,29,2.83,qt,"6.7,5.9"
H,30,3.72,d,5.9
H,31,3.72,d,5.9
H,32,,,
H,33,4.31,d,5.4
H,34,4.31,d,5.4
H,35,3.55,dt,"7.2,5.4"
H,36,4.91,d,7.9
H,37,6.91,ddd,"7.9,1.9,0.5"
H,38,6.67,ddd,"7.9,1.9,0.5"
H,39,,,
H,40,6.67,ddd,"7.3,1.9,0.5"
H,41,6.91,ddd,"7.3,1.9,0.5"
H,42,3.45,dd,"7.9,7.7"
H,43,,,
H,44,3.58,dd,"7.7,7.6"
H,45,,,
H,46,3.42,dd,"7.6,7.2"
H,47,,,
