@MOLECULE o-xylylamine 20 20 0 0 0 SMALL USER_CHARGES @ATOM 1 N -2.6381 -0.6381 0.6995 N.3 1 UNL1111111 -0.6187 2 C -0.3801 -0.3183 -0.2909 C.ar 1 UNL1111111 -0.0962 3 C 0.1772 0.9475 -0.0743 C.ar 1 UNL1111111 0.0327 4 C -1.8551 -0.4979 -0.5471 C.3 1 UNL1111111 -0.1148 5 C 0.4356 -1.4498 -0.2441 C.ar 1 UNL1111111 -0.1489 6 C 1.5441 1.0602 0.1959 C.ar 1 UNL1111111 -0.1826 7 C -0.6546 2.1847 -0.1389 C.3 1 UNL1111111 -0.4548 8 C 1.7969 -1.3323 0.0225 C.ar 1 UNL1111111 -0.1655 9 C 2.3507 -0.0732 0.2454 C.ar 1 UNL1111111 -0.1334 10 H -2.2759 0.3572 -1.1240 H 1 UNL1111111 0.1525 11 H -2.0465 -1.3981 -1.1758 H 1 UNL1111111 0.1510 12 H 0.0050 -2.4349 -0.4188 H 1 UNL1111111 0.1509 13 H 1.9834 2.0412 0.3670 H 1 UNL1111111 0.1540 14 H -1.0196 2.3625 -1.1626 H 1 UNL1111111 0.1634 15 H -1.5354 2.1248 0.5155 H 1 UNL1111111 0.1584 16 H -0.0986 3.0841 0.1603 H 1 UNL1111111 0.1572 17 H 2.4248 -2.2195 0.0551 H 1 UNL1111111 0.1528 18 H 3.4141 0.0251 0.4564 H 1 UNL1111111 0.1512 19 H -2.5314 0.1688 1.2938 H 1 UNL1111111 0.2443 20 H -2.3505 -1.4510 1.2223 H 1 UNL1111111 0.2464 @BOND 1 11 4 1 2 14 7 1 3 10 4 1 4 4 2 1 5 4 1 1 6 12 5 1 7 2 5 ar 8 2 3 ar 9 5 8 ar 10 7 3 1 11 7 16 1 12 7 15 1 13 3 6 ar 14 8 17 1 15 8 9 ar 16 6 9 ar 17 6 13 1 18 9 18 1 19 1 20 1 20 1 19 1