C,1,17.8,s,
C,2,129.35,s,
C,3,129.1,s,
C,4,76.0,s,
O,5,,,
C,6,41.6,s,
C,7,18.77,s,
C,8,18.77,s,
C,9,78.5,s,
C,10,28.6,s,
C,11,129.97,s,
C,12,133.32,s,
C,13,53.76,s,
O,14,,,
C,15,53.76,s,
C,16,133.32,s,
C,17,130.27,s,
C,18,132.45,s,
C,19,118.64,s,
C,20,161.5,s,
N,21,,,
C,22,133.4,s,
C,23,143.2,s,
O,24,,,
C,25,161.1,s,
O,26,,,
O,27,,,
C,28,78.5,s,
C,29,41.6,s,
C,30,18.77,s,
C,31,18.77,s,
C,32,76.0,s,
O,33,,,
C,34,129.1,s,
C,35,129.35,s,
C,36,17.8,s,
C,37,28.6,s,
C,38,129.97,s,
C,39,133.32,s,
C,40,53.76,s,
O,41,,,
C,42,53.76,s,
C,43,133.32,s,
C,44,130.27,s,
C,45,132.45,s,
C,46,118.64,s,
C,47,161.5,s,
N,48,,,
C,49,133.4,s,
C,50,143.2,s,
O,51,,,
C,52,161.1,s,
O,53,,,
O,54,,,
H,55,1.64,d,7.0
H,56,1.64,d,7.0
H,57,1.64,d,7.0
H,58,5.4,dq,"11.0,7.0"
H,59,5.4,dd,"11.0,7.0"
H,60,3.79,d,7.0
H,61,,,
H,62,0.89,s,
H,63,0.89,s,
H,64,0.89,s,
H,65,0.89,s,
H,66,0.89,s,
H,67,0.89,s,
H,68,5.18,dd,"12.8,4.0"
H,69,2.53,ddd,"15.4,12.8,3.6"
H,70,2.53,ddd,"15.4,11.5,4.0"
H,71,5.7,dd,"11.5,3.6"
H,72,6.14,d,3.9
H,73,4.57,dd,"7.7,3.9"
H,74,4.57,dd,"7.7,5.9"
H,75,6.14,d,5.9
H,76,6.99,d,4.5
H,77,6.57,d,4.5
H,78,6.13,s,
H,79,7.99,s,
H,80,5.18,dd,"10.3,4.4"
H,81,0.89,s,
H,82,0.89,s,
H,83,0.89,s,
H,84,0.89,s,
H,85,0.89,s,
H,86,0.89,s,
H,87,3.79,d,7.0
H,88,,,
H,89,5.4,dd,"15.0,7.0"
H,90,5.4,dq,"15.0,7.0"
H,91,1.64,d,7.0
H,92,1.64,d,7.0
H,93,1.64,d,7.0
H,94,2.53,ddd,"15.4,10.5,10.3"
H,95,2.53,ddd,"15.4,4.4,2.6"
H,96,5.7,dd,"10.5,2.6"
H,97,6.14,d,5.6
H,98,4.57,dd,"8.4,5.6"
H,99,4.57,dd,"11.1,8.4"
H,100,6.14,d,11.1
H,101,6.99,d,4.3
H,102,6.57,d,4.3
H,103,6.13,s,
H,104,7.99,s,
