C,1,20.9,s,
C,2,169.3,s,
O,3,,,
O,4,,,
C,5,73.95,s,
C,6,103.29,s,
O,7,,,
C,8,77.06,s,
C,9,44.32,s,
C,10,43.99,s,
C,11,17.82,s,
C,12,43.9,s,
C,13,24.1,s,
C,14,123.25,s,
C,15,149.11,s,
C,16,47.74,s,
C,17,35.12,s,
C,18,71.67,s,
O,19,,,
C,20,,,
O,21,,,
C,22,47.47,s,
C,23,23.93,s,
C,24,23.93,s,
C,25,49.0,s,
C,26,20.3,s,
C,27,,,
O,28,,,
C,29,48.7,s,
C,30,43.99,s,
C,31,17.82,s,
C,32,47.92,s,
C,33,77.1,s,
C,34,26.44,s,
O,35,,,
C,36,197.92,s,
O,37,,,
C,38,129.35,s,
C,39,135.73,s,
C,40,71.24,s,
C,41,29.42,s,
C,42,29.42,s,
O,43,,,
O,44,,,
C,45,65.7,s,
C,46,16.7,s,
C,47,74.5,s,
O,48,,,
C,49,171.3,s,
C,50,20.83,s,
O,51,,,
C,52,74.1,s,
O,53,,,
H,54,1.99,s,
H,55,1.99,s,
H,56,1.99,s,
H,57,5.43,dd,"5.4,1.8"
H,58,5.14,d,1.8
H,59,4.88,ddd,"8.8,6.2,4.8"
H,60,2.2,dd,"12.4,8.8"
H,61,2.2,dd,"12.4,6.2"
H,62,0.99,s,
H,63,0.99,s,
H,64,0.99,s,
H,65,1.9,dd,"12.4,6.0"
H,66,2.38,ddd,"15.4,6.0,4.0"
H,67,2.38,ddd,"15.4,12.4,3.7"
H,68,5.48,dd,"4.0,3.7"
H,69,2.94,dd,"12.6,5.8"
H,70,1.88,ddd,"12.6,12.4,6.7"
H,71,1.88,ddd,"12.4,5.8,1.6"
H,72,4.7,dd,"6.7,1.6"
H,73,,,
H,74,1.13,s,
H,75,1.13,s,
H,76,1.13,s,
H,77,1.13,s,
H,78,1.13,s,
H,79,1.13,s,
H,80,1.29,s,
H,81,1.29,s,
H,82,1.29,s,
H,83,2.57,s,
H,84,2.57,s,
H,85,1.02,s,
H,86,1.02,s,
H,87,1.02,s,
H,88,3.07,d,4.8
H,89,1.68,s,
H,90,1.68,s,
H,91,1.68,s,
H,92,,,
H,93,6.72,d,16.0
H,94,6.95,d,16.0
H,95,1.3,s,
H,96,1.3,s,
H,97,1.3,s,
H,98,1.3,s,
H,99,1.3,s,
H,100,1.3,s,
H,101,,,
H,102,4.14,dq,"8.3,6.1"
H,103,1.24,d,6.1
H,104,1.24,d,6.1
H,105,1.24,d,6.1
H,106,4.92,dd,"8.3,7.1"
H,107,2.1,s,
H,108,2.1,s,
H,109,2.1,s,
H,110,3.97,dd,"7.1,5.4"
H,111,,,
