C,1,106.3,s,
C,2,145.4,s,
C,3,76.56,s,
O,4,,,
C,5,76.9,s,
C,6,28.64,s,
C,7,19.33,s,
C,8,19.33,s,
C,9,38.53,s,
C,10,78.41,s,
O,11,,,
C,12,164.75,s,
O,13,,,
C,14,126.25,s,
C,15,137.32,s,
C,16,123.64,s,
C,17,153.57,s,
N,18,,,
C,19,150.9,s,
C,20,41.47,s,
C,21,22.43,s,
C,22,22.43,s,
C,23,144.6,s,
C,24,132.9,s,
C,25,44.7,s,
C,26,19.7,s,
C,27,,,
O,28,,,
C,29,86.34,s,
O,30,,,
C,31,170.1,s,
C,32,20.5,s,
O,33,,,
C,34,30.5,s,
C,35,80.53,s,
C,36,23.64,s,
O,37,,,
C,38,170.11,s,
C,39,21.54,s,
O,40,,,
C,41,76.57,s,
O,42,,,
C,43,169.94,s,
C,44,21.13,s,
O,45,,,
C,46,49.6,s,
C,47,70.1,s,
O,48,,,
C,49,168.8,s,
C,50,20.9,s,
O,51,,,
H,52,5.27,s,
H,53,5.27,s,
H,54,5.61,dd,"4.6,3.5"
H,55,3.32,d,5.5
H,56,3.32,d,5.5
H,57,1.95,m,"6.4,5.5"
H,58,0.91,d,6.4
H,59,0.91,d,6.4
H,60,0.91,d,6.4
H,61,0.91,d,6.4
H,62,0.91,d,6.4
H,63,0.91,d,6.4
H,64,2.94,ddd,"12.4,3.5,0.9"
H,65,2.94,ddd,"12.4,8.4,4.6"
H,66,4.37,dd,"8.4,0.9"
H,67,8.57,ddd,"6.9,1.9,1.4"
H,68,7.48,ddd,"6.9,4.3,0.5"
H,69,8.78,dd,"4.3,1.4"
H,70,9.55,dd,"1.9,0.5"
H,71,0.94,s,
H,72,0.94,s,
H,73,0.94,s,
H,74,0.94,s,
H,75,0.94,s,
H,76,0.94,s,
H,77,5.22,d,11.0
H,78,6.16,dd,"11.0,5.3"
H,79,2.83,qd,"6.9,5.3"
H,80,1.03,d,6.9
H,81,1.03,d,6.9
H,82,1.03,d,6.9
H,83,2.2,s,
H,84,2.2,s,
H,85,2.2,s,
H,86,2.51,s,
H,87,2.51,s,
H,88,1.73,s,
H,89,1.73,s,
H,90,1.73,s,
H,91,2.06,s,
H,92,2.06,s,
H,93,2.06,s,
H,94,5.19,d,7.7
H,95,2.04,s,
H,96,2.04,s,
H,97,2.04,s,
H,98,2.96,dd,"11.1,7.7"
H,99,5.21,d,11.1
H,100,2.04,s,
H,101,2.04,s,
H,102,2.04,s,
