@MOLECULE 1-(2-hydroxyethyl)-3-nitro-1h-pyrazole-4-carboxamide 22 22 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.9074 -0.6578 0.2128 O.3 1 UNL1111111111 -0.5317 2 O 2.8842 1.1173 -1.2710 O.2 1 UNL1111111111 -0.4747 3 O 2.0781 -1.9062 0.4067 O.2 1 UNL1111111111 -0.3796 4 O 0.2502 -2.7741 -0.3488 O.2 1 UNL1111111111 -0.3443 5 N -1.2913 0.9297 0.1317 N.ar 1 UNL1111111111 -0.0520 6 N -1.0473 -0.3926 0.1284 N.ar 1 UNL1111111111 -0.2114 7 N 0.9236 -1.8330 0.0214 N.pl3 1 UNL1111111111 0.6490 8 N 3.0858 1.2770 0.9722 N.am 1 UNL1111111111 -0.6655 9 C -2.6661 1.4176 0.2519 C.3 1 UNL1111111111 -0.1452 10 C 0.9328 0.7507 0.0094 C.ar 1 UNL1111111111 -0.1956 11 C -0.1223 1.6694 0.0697 C.ar 1 UNL1111111111 -0.0673 12 C 0.3090 -0.5276 0.0449 C.ar 1 UNL1111111111 0.0032 13 C -3.6643 0.5156 -0.5131 C.3 1 UNL1111111111 0.0038 14 C 2.3647 1.0412 -0.1792 C.2 1 UNL1111111111 0.6127 15 H -2.9510 1.4319 1.3374 H 1 UNL1111111111 0.1824 16 H -2.7118 2.4648 -0.1249 H 1 UNL1111111111 0.1617 17 H -0.0991 2.7443 0.0632 H 1 UNL1111111111 0.1927 18 H -4.6606 0.9955 -0.5737 H 1 UNL1111111111 0.1509 19 H -3.3011 0.2663 -1.5270 H 1 UNL1111111111 0.1397 20 H -3.0818 -1.2036 0.2586 H 1 UNL1111111111 0.3472 21 H 2.7099 1.1420 1.8822 H 1 UNL1111111111 0.3067 22 H 4.0777 1.4253 0.9083 H 1 UNL1111111111 0.3174 @BOND 1 1 13 1 2 1 20 1 3 2 14 2 4 3 7 2 5 4 7 2 6 5 6 ar 7 5 9 1 8 5 11 ar 9 6 12 ar 10 7 12 1 11 8 14 am 12 8 21 1 13 8 22 1 14 9 13 1 15 9 15 1 16 9 16 1 17 10 11 ar 18 10 12 ar 19 10 14 1 20 11 17 1 21 13 18 1 22 13 19 1