C,1,11.3,s,
C,2,25.7,s,
C,3,34.6,s,
C,4,15.7,s,
C,5,64.2,s,
C,6,171.0,s,
O,7,,,
O,8,,,
C,9,77.6,s,
C,10,29.6,s,
C,11,18.3,s,
C,12,18.3,s,
C,13,171.19,s,
O,14,,,
N,15,,,
C,16,31.45,s,
C,17,64.2,s,
C,18,34.6,s,
C,19,15.7,s,
C,20,25.7,s,
C,21,11.3,s,
C,22,171.0,s,
O,23,,,
O,24,,,
C,25,77.6,s,
C,26,29.6,s,
C,27,18.3,s,
C,28,18.3,s,
C,29,171.19,s,
O,30,,,
N,31,,,
C,32,31.45,s,
C,33,60.44,s,
C,34,27.25,s,
C,35,17.42,s,
C,36,17.42,s,
C,37,171.0,s,
O,38,,,
O,39,,,
C,40,77.6,s,
C,41,29.6,s,
C,42,18.3,s,
C,43,18.3,s,
C,44,171.19,s,
O,45,,,
N,46,,,
C,47,31.45,s,
H,48,0.77,t,7.0
H,49,0.77,t,7.0
H,50,0.77,t,7.0
H,51,1.25,qd,"7.0,6.0"
H,52,1.25,qd,"7.0,6.0"
H,53,2.03,qtd,"6.5,6.0,5.7"
H,54,0.77,d,6.5
H,55,0.77,d,6.5
H,56,0.77,d,6.5
H,57,4.45,d,5.7
H,58,4.64,d,5.2
H,59,2.29,m,"6.4,5.2"
H,60,0.95,d,6.4
H,61,0.95,d,6.4
H,62,0.95,d,6.4
H,63,0.95,d,6.4
H,64,0.95,d,6.4
H,65,0.95,d,6.4
H,66,2.91,s,
H,67,2.91,s,
H,68,2.91,s,
H,69,4.45,d,5.7
H,70,2.03,qtd,"6.5,6.0,5.7"
H,71,0.77,d,6.5
H,72,0.77,d,6.5
H,73,0.77,d,6.5
H,74,1.25,qd,"7.0,6.0"
H,75,1.25,qd,"7.0,6.0"
H,76,0.77,t,7.0
H,77,0.77,t,7.0
H,78,0.77,t,7.0
H,79,4.64,d,5.2
H,80,2.29,m,"6.4,5.2"
H,81,0.95,d,6.4
H,82,0.95,d,6.4
H,83,0.95,d,6.4
H,84,0.95,d,6.4
H,85,0.95,d,6.4
H,86,0.95,d,6.4
H,87,2.91,s,
H,88,2.91,s,
H,89,2.91,s,
H,90,4.45,d,5.7
H,91,2.14,m,"6.4,5.7"
H,92,1.08,d,6.4
H,93,1.08,d,6.4
H,94,1.08,d,6.4
H,95,1.08,d,6.4
H,96,1.08,d,6.4
H,97,1.08,d,6.4
H,98,4.64,d,5.2
H,99,2.29,m,"6.4,5.2"
H,100,0.95,d,6.4
H,101,0.95,d,6.4
H,102,0.95,d,6.4
H,103,0.95,d,6.4
H,104,0.95,d,6.4
H,105,0.95,d,6.4
H,106,2.91,s,
H,107,2.91,s,
H,108,2.91,s,
