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,6,33.77,s,
C,7,43.99,s,
C,8,17.82,s,
C,9,42.9,s,
C,10,28.16,s,
C,11,35.28,s,
C,12,41.86,s,
C,13,35.28,s,
C,14,26.93,s,
C,15,28.16,s,
C,16,56.7,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,34,65.7,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,dtd,"13.3,12.4,4.1"
H,45,1.59,ddd,"12.4,4.1,3.1"
H,46,1.59,ddd,"13.3,12.4,4.6"
H,47,1.02,s,
H,48,1.02,s,
H,49,1.02,s,
H,50,1.94,ddd,"9.2,5.9,0.9"
H,51,1.58,m,
H,52,1.58,m,
H,53,1.72,ddd,"12.4,11.9,5.3"
H,54,1.72,ddd,"12.4,11.6,4.4"
H,55,1.72,ddd,"12.4,10.9,7.3"
H,56,1.72,ddd,"12.4,10.1,2.4"
H,57,1.42,m,
H,58,1.42,m,
H,59,1.58,m,
H,60,1.58,m,
H,61,1.14,dd,"7.2,0.2"
H,62,1.72,t,6.8
H,63,1.72,t,6.8
H,64,2.67,t,6.8
H,65,2.67,t,6.8
H,66,0.9,s,
H,67,0.9,s,
H,68,0.9,s,
H,69,4.11,s,
H,70,4.11,s,
H,71,1.35,s,
H,72,1.35,s,
H,73,1.35,s,
H,74,1.97,ddd,"12.4,11.8,2.4"
H,75,1.97,ddd,"12.4,11.0,6.4"
H,76,2.0,m,
H,77,2.0,m,
H,78,4.78,dd,"8.2,0.4"
H,79,4.28,d,0.6
H,80,,,
H,81,4.28,d,5.9
