C,1,20.75,s,
C,2,31.2,s,
C,3,20.75,s,
C,4,41.32,s,
C,5,28.4,s,
C,6,43.3,s,
C,7,38.4,s,
C,8,26.2,s,
C,9,50.07,s,
C,10,28.16,s,
C,11,27.07,s,
C,12,40.28,s,
C,13,32.05,s,
C,14,26.37,s,
C,15,29.1,s,
C,16,50.54,s,
C,17,49.5,s,
C,18,35.28,s,
C,19,38.33,s,
C,20,,,
O,21,,,
C,22,50.8,s,
C,23,19.8,s,
C,24,66.6,s,
O,25,,,
C,26,106.7,s,
C,27,24.3,s,
C,28,35.1,s,
C,29,25.4,s,
C,30,83.2,s,
O,31,,,
C,32,65.7,s,
N,33,,,
C,34,49.88,s,
H,35,0.99,d,6.4
H,36,0.99,d,6.4
H,37,0.99,d,6.4
H,38,1.65,m,"6.4,5.4"
H,39,0.99,d,6.4
H,40,0.99,d,6.4
H,41,0.99,d,6.4
H,42,2.26,m,
H,43,1.72,m,
H,44,1.72,m,
H,45,1.53,ddd,"12.4,11.8,2.2"
H,46,1.53,ddd,"12.4,11.5,3.9"
H,47,0.93,s,
H,48,0.93,s,
H,49,0.93,s,
H,50,2.24,tdd,"8.0,1.8,1.7"
H,51,1.58,dtd,"12.4,8.0,1.3"
H,52,1.58,m,
H,53,1.58,m,
H,54,1.58,m,
H,55,1.59,m,
H,56,1.58,m,
H,57,1.58,m,
H,58,1.64,m,
H,59,1.64,m,
H,60,1.58,m,
H,61,1.58,m,
H,62,1.61,ddd,"12.8,9.6,3.2"
H,63,1.72,t,6.8
H,64,1.72,t,6.8
H,65,2.67,t,6.8
H,66,2.67,t,6.8
H,67,0.9,s,
H,68,0.9,s,
H,69,0.9,s,
H,70,4.11,s,
H,71,4.11,s,
H,72,1.35,s,
H,73,1.35,s,
H,74,1.35,s,
H,75,1.97,ddd,"12.4,11.5,1.1"
H,76,1.97,ddd,"12.4,9.6,8.6"
H,77,2.0,m,
H,78,2.0,ddd,"12.4,9.6,1.1"
H,79,4.78,d,8.0
H,80,4.28,d,1.7
H,81,,,
H,82,3.21,dd,"12.4,1.7"
H,83,3.21,dd,"12.4,8.0"
