C,1,13.68,s,
C,2,19.0,s,
C,3,30.57,s,
C,4,64.76,s,
O,5,,,
C,6,171.25,s,
O,7,,,
C,8,38.9,s,
C,9,72.7,s,
C,10,20.86,s,
O,11,,,
C,12,96.58,s,
O,13,,,
C,14,68.4,s,
C,15,66.0,s,
O,16,,,
C,17,100.4,s,
O,18,,,
C,19,62.7,s,
C,20,67.4,s,
O,21,,,
C,22,171.18,s,
C,23,20.68,s,
O,24,,,
C,25,69.9,s,
O,26,,,
C,27,169.34,s,
C,28,20.64,s,
O,29,,,
C,30,68.9,s,
O,31,,,
C,32,170.04,s,
C,33,20.7,s,
O,34,,,
C,35,69.66,s,
O,36,,,
C,37,169.6,s,
C,38,20.72,s,
O,39,,,
C,40,71.9,s,
O,41,,,
C,42,169.7,s,
C,43,20.8,s,
O,44,,,
C,45,70.96,s,
O,46,,,
C,47,170.36,s,
C,48,21.21,s,
O,49,,,
H,50,0.92,t,7.0
H,51,0.92,t,7.0
H,52,0.92,t,7.0
H,53,1.42,qt,"7.0,6.5"
H,54,1.42,qt,"7.0,6.5"
H,55,1.55,tt,"6.5,6.3"
H,56,1.55,tt,"6.5,6.3"
H,57,4.1,t,6.3
H,58,4.1,t,6.3
H,59,2.64,d,5.7
H,60,2.64,d,5.7
H,61,4.53,qt,"6.0,5.7"
H,62,1.29,d,6.0
H,63,1.29,d,6.0
H,64,1.29,d,6.0
H,65,5.18,d,3.0
H,66,3.97,dt,"6.3,5.3"
H,67,3.48,d,5.3
H,68,3.48,d,5.3
H,69,4.54,d,2.7
H,70,3.98,dd,"9.4,4.4"
H,71,3.98,dd,"10.7,9.4"
H,72,5.06,ddd,"10.7,10.1,4.4"
H,73,2.02,s,
H,74,2.02,s,
H,75,2.02,s,
H,76,5.18,dd,"10.1,2.0"
H,77,2.03,s,
H,78,2.03,s,
H,79,2.03,s,
H,80,5.24,dd,"2.7,2.0"
H,81,1.99,s,
H,82,1.99,s,
H,83,1.99,s,
H,84,5.07,dd,"10.4,6.3"
H,85,2.03,s,
H,86,2.03,s,
H,87,2.03,s,
H,88,5.15,dd,"10.6,10.4"
H,89,2.03,s,
H,90,2.03,s,
H,91,2.03,s,
H,92,5.57,dd,"10.6,3.0"
H,93,1.99,s,
H,94,1.99,s,
H,95,1.99,s,
