C,1,21.23,s,
C,2,170.21,s,
O,3,,,
O,4,,,
C,5,77.06,s,
C,6,44.32,s,
C,7,47.59,s,
C,8,18.0,s,
C,9,49.26,s,
C,10,25.73,s,
C,11,30.17,s,
C,12,52.03,s,
C,13,137.05,s,
C,14,128.29,s,
C,15,138.9,s,
C,16,128.11,s,
C,17,38.17,s,
C,18,43.99,s,
C,19,17.82,s,
C,20,40.4,s,
C,21,57.53,s,
C,22,19.8,s,
N,23,,,
C,24,162.36,s,
O,25,,,
C,26,126.21,s,
C,27,127.79,s,
C,28,128.69,s,
C,29,131.72,s,
C,30,128.69,s,
C,31,127.79,s,
C,32,41.39,s,
C,33,23.15,s,
C,34,71.56,s,
N,35,,,
C,36,44.63,s,
C,37,44.63,s,
C,38,41.86,s,
C,39,23.79,s,
C,40,23.79,s,
H,41,2.02,s,
H,42,2.02,s,
H,43,2.02,s,
H,44,4.88,ddd,"7.8,3.5,1.5"
H,45,2.2,dd,"12.4,1.5"
H,46,2.2,dd,"12.4,7.8"
H,47,1.02,s,
H,48,1.02,s,
H,49,1.02,s,
H,50,2.68,dd,"12.2,1.5"
H,51,1.46,m,
H,52,1.46,m,
H,53,1.46,m,
H,54,1.46,m,
H,55,2.94,dd,"13.9,4.5"
H,56,7.39,s,
H,57,5.54,dd,"4.2,3.1"
H,58,2.03,dd,"15.4,4.2"
H,59,2.03,dd,"15.4,3.1"
H,60,1.02,s,
H,61,1.02,s,
H,62,1.02,s,
H,63,2.83,dd,"5.4,3.5"
H,64,4.28,qd,"6.3,5.4"
H,65,1.29,d,6.3
H,66,1.29,d,6.3
H,67,1.29,d,6.3
H,68,,,
H,69,7.97,m,
H,70,7.43,m,
H,71,7.45,ddt,"8.3,7.2,1.4"
H,72,7.43,m,
H,73,7.97,m,
H,74,2.37,ddd,"15.4,12.9,2.0"
H,75,2.37,ddd,"15.4,4.2,2.8"
H,76,1.84,m,
H,77,1.84,m,
H,78,3.78,dd,"11.9,7.3"
H,79,2.38,s,
H,80,2.38,s,
H,81,2.38,s,
H,82,2.38,s,
H,83,2.38,s,
H,84,2.38,s,
H,85,1.13,s,
H,86,1.13,s,
H,87,1.13,s,
H,88,1.13,s,
H,89,1.13,s,
H,90,1.13,s,
