3 atoms 2 bonds 1 angles Types 1 16 2 17 3 16 Charges 1 0 2 0 3 0 Coords 1 4.8448661973296110e+00 2.0625647512974608e+00 7.2506090938571326e+00 2 3.9579098758389719e+00 1.4400053945238196e+00 7.6151030027270421e+00 3 3.0929357458524969e+00 7.8568457463912567e-01 8.0632505773817407e+00 Bonds 1 20 1 2 2 20 2 3 Angles 1 35 1 2 3 Special Bond Counts 1 1 1 0 2 2 0 0 3 1 1 0 Special Bonds 1 2 3 2 1 3 3 2 1