C,1,13.14,s,
C,2,48.08,s,
N,3,,,
C,4,62.58,s,
C,5,41.86,s,
C,6,72.44,s,
O,7,,,
C,8,58.89,s,
C,9,144.6,s,
C,10,133.32,s,
C,11,81.22,s,
O,12,,,
C,13,56.6,s,
C,14,49.44,s,
C,15,41.4,s,
C,16,36.2,s,
C,17,74.2,s,
O,18,,,
C,19,83.52,s,
O,20,,,
C,21,49.1,s,
C,22,40.59,s,
C,23,85.8,s,
O,24,,,
C,25,165.7,s,
O,26,,,
C,27,128.1,s,
C,28,131.99,s,
C,29,113.7,s,
C,30,163.46,s,
O,31,,,
C,32,55.32,s,
C,33,113.7,s,
C,34,131.99,s,
C,35,48.16,s,
C,36,79.1,s,
O,37,,,
C,38,166.26,s,
O,39,,,
C,40,123.71,s,
C,41,131.99,s,
C,42,113.7,s,
C,43,163.46,s,
O,44,,,
C,45,55.32,s,
C,46,113.7,s,
C,47,131.99,s,
C,48,46.79,s,
C,49,81.34,s,
O,50,,,
C,51,57.68,s,
C,52,51.51,s,
C,53,60.94,s,
H,54,1.07,t,6.8
H,55,1.07,t,6.8
H,56,1.07,t,6.8
H,57,2.5,q,6.8
H,58,2.5,q,6.8
H,59,3.17,s,
H,60,3.17,s,
H,61,4.13,s,
H,62,4.13,s,
H,63,3.28,s,
H,64,3.28,s,
H,65,3.28,s,
H,66,6.3,s,
H,67,6.14,d,6.6
H,68,4.9,d,6.6
H,69,3.42,s,
H,70,3.42,s,
H,71,3.42,s,
H,72,2.08,ddd,"10.7,8.0,5.1"
H,73,1.96,dd,"12.4,5.1"
H,74,1.96,dd,"12.4,10.7"
H,75,,,
H,76,4.54,dd,"10.2,2.4"
H,77,3.28,s,
H,78,3.28,s,
H,79,3.28,s,
H,80,3.0,dd,"12.4,10.2"
H,81,3.0,dd,"12.4,2.4"
H,82,8.02,ddd,"6.6,1.9,0.5"
H,83,6.88,ddd,"6.6,1.9,0.5"
H,84,3.76,s,
H,85,3.76,s,
H,86,3.76,s,
H,87,6.88,ddd,"8.6,1.9,0.5"
H,88,8.02,ddd,"8.6,1.9,0.5"
H,89,2.84,dd,"8.0,2.2"
H,90,4.96,d,2.2
H,91,7.94,ddd,"7.3,1.9,0.5"
H,92,6.88,ddd,"7.3,1.9,0.5"
H,93,3.76,s,
H,94,3.76,s,
H,95,3.76,s,
H,96,6.88,ddd,"6.5,1.9,0.5"
H,97,7.94,ddd,"6.5,1.9,0.5"
H,98,2.42,dd,"1.6,1.0"
H,99,4.22,dd,"7.8,1.6"
H,100,3.27,s,
H,101,3.27,s,
H,102,3.27,s,
H,103,2.9,d,7.8
H,104,2.83,d,1.0
