@MOLECULE cycloheptanamine 23 23 0 0 0 SMALL USER_CHARGES @ATOM 1 N -2.6881 0.1080 0.1467 N.3 1 UNL1111111 -0.6692 2 C -1.2756 0.0818 -0.3011 C.3 1 UNL1111111 0.0704 3 C -0.7137 -1.3163 0.0245 C.3 1 UNL1111111 -0.2893 4 C -0.4428 1.2195 0.3399 C.3 1 UNL1111111 -0.3275 5 C 0.7392 -1.4902 -0.4303 C.3 1 UNL1111111 -0.2606 6 C 0.8542 1.4649 -0.4389 C.3 1 UNL1111111 -0.2556 7 C 1.7243 -0.7804 0.5091 C.3 1 UNL1111111 -0.2619 8 C 2.0524 0.6572 0.0819 C.3 1 UNL1111111 -0.2677 9 H -1.2896 0.2189 -1.4141 H 1 UNL1111111 0.1371 10 H -1.3564 -2.0733 -0.4708 H 1 UNL1111111 0.1510 11 H -0.8013 -1.5215 1.1067 H 1 UNL1111111 0.1373 12 H -0.2210 0.9842 1.3949 H 1 UNL1111111 0.1459 13 H -1.0419 2.1485 0.3572 H 1 UNL1111111 0.1300 14 H 0.8656 -1.1270 -1.4666 H 1 UNL1111111 0.1410 15 H 0.9779 -2.5712 -0.4654 H 1 UNL1111111 0.1301 16 H 1.1087 2.5424 -0.4027 H 1 UNL1111111 0.1298 17 H 0.6953 1.2407 -1.5118 H 1 UNL1111111 0.1364 18 H 2.6664 -1.3597 0.5649 H 1 UNL1111111 0.1283 19 H 1.3220 -0.7799 1.5401 H 1 UNL1111111 0.1358 20 H 2.5069 1.1887 0.9419 H 1 UNL1111111 0.1314 21 H 2.8337 0.6367 -0.7030 H 1 UNL1111111 0.1317 22 H -3.1431 0.9743 -0.0857 H 1 UNL1111111 0.2484 23 H -2.7791 -0.0527 1.1355 H 1 UNL1111111 0.2472 @BOND 1 17 6 1 2 14 5 1 3 9 2 1 4 21 8 1 5 10 3 1 6 15 5 1 7 6 16 1 8 6 8 1 9 6 4 1 10 5 3 1 11 5 7 1 12 2 3 1 13 2 1 1 14 2 4 1 15 22 1 1 16 3 11 1 17 8 7 1 18 8 20 1 19 1 23 1 20 4 13 1 21 4 12 1 22 7 18 1 23 7 19 1