C,1,20.55,s,
C,2,169.77,s,
O,3,,,
O,4,,,
C,5,73.73,s,
C,6,,,
O,7,,,
C,8,54.58,s,
C,9,23.45,s,
C,10,75.84,s,
O,11,,,
C,12,38.12,s,
C,13,84.99,s,
O,14,,,
C,15,74.9,s,
C,16,81.77,s,
O,17,,,
C,18,170.27,s,
C,19,21.99,s,
O,20,,,
C,21,47.92,s,
C,22,73.19,s,
O,23,,,
C,24,167.75,s,
O,25,,,
C,26,130.0,s,
C,27,129.11,s,
C,28,128.88,s,
C,29,133.32,s,
C,30,128.88,s,
C,31,129.11,s,
C,32,77.84,s,
O,33,,,
C,34,37.48,s,
C,35,71.01,s,
O,36,,,
C,37,172.05,s,
O,38,,,
C,39,71.85,s,
O,40,,,
C,41,68.3,s,
N,42,,,
C,43,162.36,s,
O,44,,,
C,45,126.21,s,
C,46,127.79,s,
C,47,128.69,s,
C,48,131.72,s,
C,49,128.69,s,
C,50,127.79,s,
C,51,140.8,s,
C,52,126.91,s,
C,53,128.52,s,
C,54,127.66,s,
C,55,128.52,s,
C,56,126.91,s,
C,57,137.72,s,
C,58,15.42,s,
C,59,141.82,s,
C,60,43.16,s,
C,61,24.93,s,
C,62,24.93,s,
H,63,2.16,s,
H,64,2.16,s,
H,65,2.16,s,
H,66,6.27,s,
H,67,1.66,s,
H,68,1.66,s,
H,69,1.66,s,
H,70,4.41,dd,"9.5,1.0"
H,71,,,
H,72,2.48,ddd,"12.4,5.4,1.0"
H,73,2.48,ddd,"12.4,9.5,1.7"
H,74,4.92,dd,"5.4,1.7"
H,75,4.28,s,
H,76,4.28,s,
H,77,2.3,s,
H,78,2.3,s,
H,79,2.3,s,
H,80,3.8,d,9.6
H,81,5.65,d,9.6
H,82,8.03,m,
H,83,7.46,m,
H,84,7.57,ddt,"9.3,7.0,1.4"
H,85,7.46,m,
H,86,8.03,m,
H,87,,,
H,88,2.22,dd,"12.4,5.7"
H,89,2.22,dd,"12.4,10.6"
H,90,6.17,dd,"10.6,5.7"
H,91,4.58,d,5.3
H,92,,,
H,93,5.67,d,5.3
H,94,,,
H,95,7.97,m,
H,96,7.43,m,
H,97,7.45,ddt,"7.6,7.3,1.4"
H,98,7.43,m,
H,99,7.97,m,
H,100,7.34,m,
H,101,7.3,m,
H,102,7.28,ddt,"7.9,7.8,1.4"
H,103,7.3,m,
H,104,7.34,m,
H,105,1.96,s,
H,106,1.96,s,
H,107,1.96,s,
H,108,1.19,s,
H,109,1.19,s,
H,110,1.19,s,
H,111,1.19,s,
H,112,1.19,s,
H,113,1.19,s,
