C,1,23.02,s,
C,2,47.9,s,
C,3,23.02,s,
C,4,,,
O,5,,,
C,6,35.03,s,
C,7,37.98,s,
C,8,35.85,s,
C,9,15.19,s,
C,10,47.74,s,
C,11,35.12,s,
C,12,75.84,s,
O,13,,,
C,14,51.85,s,
C,15,14.45,s,
C,16,44.35,s,
C,17,24.38,s,
C,18,27.77,s,
C,19,28.49,s,
C,20,36.54,s,
C,21,21.2,s,
C,22,28.49,s,
C,23,30.55,s,
C,24,42.45,s,
C,25,25.73,s,
C,26,182.23,s,
O,27,,,
O,28,,,
C,29,46.67,s,
C,30,78.1,s,
O,31,,,
C,32,145.69,s,
C,33,116.47,s,
C,34,24.4,s,
C,35,52.37,s,
H,36,1.09,s,
H,37,1.09,s,
H,38,1.09,s,
H,39,1.09,s,
H,40,1.09,s,
H,41,1.09,s,
H,42,2.48,ddd,"15.4,5.0,2.7"
H,43,2.48,ddd,"15.4,13.3,5.2"
H,44,2.2,ddd,"12.4,5.2,2.7"
H,45,2.2,ddd,"13.3,12.4,5.0"
H,46,0.88,s,
H,47,0.88,s,
H,48,0.88,s,
H,49,2.94,dd,"9.1,9.0"
H,50,1.88,ddd,"12.4,10.0,9.1"
H,51,1.88,ddd,"12.4,9.0,3.2"
H,52,4.12,dd,"10.0,3.2"
H,53,,,
H,54,1.03,s,
H,55,1.03,s,
H,56,1.03,s,
H,57,1.26,s,
H,58,1.26,s,
H,59,1.26,s,
H,60,1.61,ddd,"12.4,11.8,3.9"
H,61,1.61,ddd,"12.4,12.0,2.2"
H,62,1.72,ddd,"12.4,12.0,3.9"
H,63,1.72,ddd,"12.4,11.8,2.2"
H,64,1.13,s,
H,65,1.13,s,
H,66,1.13,s,
H,67,1.72,ddd,"12.4,6.6,0.9"
H,68,1.72,ddd,"12.4,10.9,1.0"
H,69,1.82,ddd,"12.4,6.6,1.0"
H,70,1.82,ddd,"12.4,10.9,0.9"
H,71,1.2,s,
H,72,1.2,s,
H,73,1.2,s,
H,74,,,
H,75,2.06,s,
H,76,2.06,s,
H,77,,,
H,78,5.7,dd,"6.2,2.7"
H,79,2.22,ddd,"15.4,7.6,6.2"
H,80,2.22,ddd,"15.4,11.7,2.7"
H,81,2.11,dd,"11.7,7.6"
