C,1,20.1,s,
C,2,169.2,s,
O,3,,,
O,4,,,
C,5,56.1,s,
C,6,162.61,s,
C,7,132.74,s,
C,8,55.45,s,
C,9,,,
O,10,,,
C,11,41.86,s,
C,12,142.69,s,
C,13,137.53,s,
C,14,14.8,s,
C,15,75.0,s,
O,16,,,
C,17,77.48,s,
O,18,,,
C,19,78.03,s,
O,20,,,
C,21,169.15,s,
O,22,,,
C,23,115.59,s,
C,24,130.89,s,
C,25,120.26,s,
C,26,134.32,s,
C,27,120.3,s,
C,28,140.3,s,
N,29,,,
C,30,166.5,s,
O,31,,,
C,32,120.06,s,
C,33,127.85,s,
C,34,129.07,s,
C,35,114.57,s,
C,36,137.8,s,
O,37,,,
C,38,133.41,s,
N,39,,,
C,40,166.5,s,
O,41,,,
C,42,128.77,s,
C,43,129.91,s,
C,44,126.1,s,
C,45,131.17,s,
C,46,116.11,s,
C,47,142.35,s,
N,48,,,
C,49,44.82,s,
C,50,44.82,s,
C,51,37.31,s,
C,52,16.39,s,
C,53,34.31,s,
C,54,24.31,s,
C,55,28.19,s,
C,56,21.06,s,
C,57,22.06,s,
C,58,22.06,s,
H,59,2.06,s,
H,60,2.06,s,
H,61,2.06,s,
H,62,5.11,s,
H,63,5.11,s,
H,64,5.92,d,5.9
H,65,2.83,dd,"12.3,5.9"
H,66,5.99,s,
H,67,1.76,s,
H,68,1.76,s,
H,69,1.76,s,
H,70,4.01,s,
H,71,,,
H,72,,,
H,73,5.31,s,
H,74,7.93,ddd,"8.5,1.4,0.5"
H,75,7.43,ddd,"8.5,6.3,1.4"
H,76,7.22,ddd,"8.3,6.3,1.4"
H,77,7.15,ddd,"8.3,1.4,0.5"
H,78,10.41,s,
H,79,8.1,dd,"10.5,1.4"
H,80,7.3,dd,"10.5,6.3"
H,81,6.95,dd,"6.3,1.4"
H,82,,,
H,83,9.48,s,
H,84,8.1,ddd,"7.8,1.4,0.5"
H,85,7.41,ddd,"8.2,7.8,1.4"
H,86,7.43,ddd,"8.2,6.4,1.4"
H,87,7.32,ddd,"6.4,1.4,0.5"
H,88,2.98,s,
H,89,2.98,s,
H,90,2.98,s,
H,91,2.98,s,
H,92,2.98,s,
H,93,2.98,s,
H,94,1.82,dqd,"10.3,6.6,4.2"
H,95,0.92,d,6.6
H,96,0.92,d,6.6
H,97,0.92,d,6.6
H,98,1.89,ddd,"12.4,8.2,4.2"
H,99,1.89,ddd,"12.4,10.3,5.4"
H,100,1.48,ddd,"9.3,8.2,5.4"
H,101,1.47,dd,"12.3,9.3"
H,102,0.98,s,
H,103,0.98,s,
H,104,0.98,s,
H,105,0.98,s,
H,106,0.98,s,
H,107,0.98,s,
