C,1,15.47,s,
C,2,55.31,s,
C,3,59.7,s,
C,4,77.06,s,
O,5,,,
C,6,166.53,s,
O,7,,,
C,8,130.3,s,
C,9,130.38,s,
C,10,128.88,s,
C,11,133.32,s,
C,12,128.88,s,
C,13,130.38,s,
C,14,44.32,s,
C,15,43.99,s,
C,16,17.82,s,
C,17,49.59,s,
C,18,22.07,s,
C,19,20.79,s,
C,20,49.45,s,
C,21,23.81,s,
C,22,35.28,s,
C,23,29.71,s,
C,24,64.27,s,
N,25,,,
C,26,44.63,s,
C,27,44.63,s,
C,28,41.86,s,
C,29,23.79,s,
C,30,67.18,s,
O,31,,,
C,32,29.97,s,
C,33,20.54,s,
C,34,26.31,s,
C,35,32.64,s,
C,36,43.99,s,
C,37,17.82,s,
N,38,,,
C,39,40.0,s,
C,40,40.0,s,
H,41,1.25,d,6.3
H,42,1.25,d,6.3
H,43,1.25,d,6.3
H,44,3.34,qd,"6.3,5.4"
H,45,2.83,dd,"5.4,2.8"
H,46,4.88,ddd,"7.4,2.8,0.9"
H,47,8.03,m,
H,48,7.46,m,
H,49,7.57,ddt,"8.1,7.9,1.4"
H,50,7.46,m,
H,51,8.03,m,
H,52,2.2,dd,"12.4,0.9"
H,53,2.2,dd,"12.4,7.4"
H,54,0.99,s,
H,55,0.99,s,
H,56,0.99,s,
H,57,1.63,dd,"13.0,6.1"
H,58,1.01,m,
H,59,1.01,m,
H,60,1.13,m,
H,61,1.13,m,
H,62,1.33,dd,"12.3,5.1"
H,63,1.72,ddd,"12.4,12.1,7.3"
H,64,1.72,ddd,"12.4,5.2,2.8"
H,65,1.84,m,
H,66,1.84,m,
H,67,3.78,dd,"11.1,7.6"
H,68,2.38,s,
H,69,2.38,s,
H,70,2.38,s,
H,71,2.38,s,
H,72,2.38,s,
H,73,2.38,s,
H,74,1.13,s,
H,75,1.13,s,
H,76,1.13,s,
H,77,3.97,s,
H,78,3.97,s,
H,79,,,
H,80,0.46,s,
H,81,0.46,s,
H,82,1.7,ddd,"12.7,12.4,0.5"
H,83,1.7,ddd,"12.4,5.7,3.1"
H,84,2.01,ddd,"12.7,12.4,3.1"
H,85,2.01,ddd,"12.4,5.7,0.5"
H,86,1.02,s,
H,87,1.02,s,
H,88,1.02,s,
H,89,2.38,s,
H,90,2.38,s,
H,91,2.38,s,
H,92,2.38,s,
H,93,2.38,s,
H,94,2.38,s,
