C,1,21.99,s,
C,2,170.27,s,
O,3,,,
O,4,,,
C,5,81.77,s,
C,6,74.9,s,
O,7,,,
C,8,84.99,s,
C,9,38.12,s,
C,10,75.84,s,
O,11,,,
C,12,54.58,s,
C,13,23.45,s,
C,14,,,
O,15,,,
C,16,78.9,s,
O,17,,,
C,18,141.82,s,
C,19,137.72,s,
C,20,15.42,s,
C,21,71.01,s,
O,22,,,
C,23,172.05,s,
O,24,,,
C,25,71.85,s,
O,26,,,
C,27,59.8,s,
N,28,,,
C,29,155.52,s,
O,30,,,
O,31,,,
C,32,80.35,s,
C,33,28.33,s,
C,34,28.33,s,
C,35,28.33,s,
C,36,139.39,s,
C,37,126.91,s,
C,38,128.52,s,
C,39,127.66,s,
C,40,128.52,s,
C,41,126.91,s,
C,42,37.48,s,
C,43,77.84,s,
O,44,,,
C,45,73.19,s,
O,46,,,
C,47,167.75,s,
O,48,,,
C,49,130.0,s,
C,50,129.11,s,
C,51,128.88,s,
C,52,133.32,s,
C,53,128.88,s,
C,54,129.11,s,
C,55,47.92,s,
C,56,43.16,s,
C,57,24.93,s,
C,58,24.93,s,
H,59,2.3,s,
H,60,2.3,s,
H,61,2.3,s,
H,62,4.28,s,
H,63,4.28,s,
H,64,4.92,dd,"8.8,0.8"
H,65,2.48,ddd,"12.4,7.3,0.8"
H,66,2.48,ddd,"12.4,8.8,7.6"
H,67,4.25,dd,"7.6,7.3"
H,68,,,
H,69,1.74,s,
H,70,1.74,s,
H,71,1.74,s,
H,72,5.24,s,
H,73,,,
H,74,1.93,s,
H,75,1.93,s,
H,76,1.93,s,
H,77,6.21,dd,"11.1,3.9"
H,78,4.54,d,5.4
H,79,,,
H,80,5.23,dd,"7.0,5.4"
H,81,5.39,d,7.0
H,82,1.4,s,
H,83,1.4,s,
H,84,1.4,s,
H,85,1.4,s,
H,86,1.4,s,
H,87,1.4,s,
H,88,1.4,s,
H,89,1.4,s,
H,90,1.4,s,
H,91,7.41,m,
H,92,7.31,m,
H,93,7.28,ddt,"8.2,7.8,1.4"
H,94,7.31,m,
H,95,7.41,m,
H,96,2.22,dd,"12.4,3.9"
H,97,2.22,dd,"12.4,11.1"
H,98,,,
H,99,5.65,d,8.3
H,100,8.03,m,
H,101,7.46,m,
H,102,7.57,ddt,"9.1,6.6,1.4"
H,103,7.46,m,
H,104,8.03,m,
H,105,3.92,d,8.3
H,106,1.13,s,
H,107,1.13,s,
H,108,1.13,s,
H,109,1.13,s,
H,110,1.13,s,
H,111,1.13,s,
