C -2.079200 -1.708000 -0.000200
C -0.702000 -1.708000 -0.000200
C -0.176600 -0.375700 -0.000200
C -1.183100 0.564300 0.000600
S -2.693700 -0.152800 0.000600
~0 -2.837400 -2.764000 -0.000800
~1 -1.016600 1.853600 0.001400
+0 0.050300 -2.768200 -0.000400
+1 1.096900 -0.114300 -0.000900

1 2 2
1 5 1
1 6 1
2 3 1
2 8 1
3 4 2
3 9 1
4 5 1
4 7 1