@MOLECULE 1-cyanopiperidine 18 18 0 0 0 SMALL USER_CHARGES @ATOM 1 N 0.6136 -0.0001 0.2260 N.pl3 1 UNL11111111 -0.3586 2 N 3.1259 -0.0003 0.0152 N.1 1 UNL11111111 -0.2978 3 C -2.2445 0.0009 -0.2281 C.3 1 UNL11111111 -0.2628 4 C -1.5021 -1.2517 0.2506 C.3 1 UNL11111111 -0.2736 5 C -1.5002 1.2519 0.2519 C.3 1 UNL11111111 -0.2737 6 C -0.0491 -1.2428 -0.2526 C.3 1 UNL11111111 -0.0934 7 C -0.0481 1.2426 -0.2538 C.3 1 UNL11111111 -0.0935 8 C 1.9640 -0.0003 0.0389 C.1 1 UNL11111111 0.2158 9 H -3.2811 0.0015 0.1569 H 1 UNL11111111 0.1401 10 H -2.3309 0.0015 -1.3305 H 1 UNL11111111 0.1384 11 H -1.5128 -1.2951 1.3585 H 1 UNL11111111 0.1573 12 H -2.0118 -2.1676 -0.0995 H 1 UNL11111111 0.1419 13 H -1.5085 1.2929 1.3599 H 1 UNL11111111 0.1574 14 H -2.0099 2.1689 -0.0953 H 1 UNL11111111 0.1419 15 H -0.0218 -1.3268 -1.3602 H 1 UNL11111111 0.1290 16 H 0.5046 -2.1156 0.1623 H 1 UNL11111111 0.1513 17 H -0.0229 1.3244 -1.3616 H 1 UNL11111111 0.1291 18 H 0.5066 2.1158 0.1587 H 1 UNL11111111 0.1513 @BOND 1 17 7 1 2 15 6 1 3 10 3 1 4 7 18 1 5 7 1 1 6 7 5 1 7 6 16 1 8 6 1 1 9 6 4 1 10 3 9 1 11 3 4 1 12 3 5 1 13 12 4 1 14 14 5 1 15 2 8 3 16 8 1 1 17 4 11 1 18 5 13 1