@MOLECULE N-isohexylcyclobutanecarboxamide 34 34 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.5157 1.3873 0.3676 C.3 1 UNL11111111 -0.2741 2 C 4.8703 0.6614 0.5830 C.3 1 UNL11111111 -0.2711 3 C 4.4203 -0.4645 -0.3826 C.3 1 UNL11111111 -0.2512 4 C 3.0757 0.2761 -0.6278 C.3 1 UNL11111111 -0.2187 5 C 1.8661 -0.5187 -0.2078 C.2 1 UNL11111111 0.5787 6 O 1.8710 -1.7212 -0.0363 O.2 1 UNL11111111 -0.5371 7 N 0.7015 0.2063 -0.0491 N.am 1 UNL11111111 -0.6203 8 C -0.5283 -0.4759 0.3778 C.3 1 UNL11111111 -0.0579 9 C -1.7598 0.3351 -0.0558 C.3 1 UNL11111111 -0.3004 10 C -3.0361 -0.3637 0.4248 C.3 1 UNL11111111 -0.2839 11 C -4.2945 0.4617 0.0927 C.3 1 UNL11111111 -0.0575 12 C -4.6127 0.4016 -1.4055 C.3 1 UNL11111111 -0.4538 13 C -5.4859 -0.0719 0.8993 C.3 1 UNL11111111 -0.4573 14 H 2.9033 1.4625 1.2702 H 1 UNL11111111 0.1446 15 H 3.5981 2.3819 -0.0752 H 1 UNL11111111 0.1401 16 H 5.7450 1.2236 0.2497 H 1 UNL11111111 0.1388 17 H 5.0475 0.3320 1.6098 H 1 UNL11111111 0.1433 18 H 5.0384 -0.5858 -1.2740 H 1 UNL11111111 0.1408 19 H 4.3055 -1.4502 0.0868 H 1 UNL11111111 0.1680 20 H 2.9570 0.6300 -1.6666 H 1 UNL11111111 0.1606 21 H 0.6725 1.2030 -0.1489 H 1 UNL11111111 0.3074 22 H -0.5519 -1.5008 -0.0660 H 1 UNL11111111 0.1647 23 H -0.5123 -0.6127 1.4832 H 1 UNL11111111 0.1361 24 H -1.7117 1.3608 0.3544 H 1 UNL11111111 0.1379 25 H -1.7737 0.4445 -1.1572 H 1 UNL11111111 0.1491 26 H -3.1163 -1.3695 -0.0289 H 1 UNL11111111 0.1451 27 H -2.9819 -0.5304 1.5181 H 1 UNL11111111 0.1401 28 H -4.1174 1.5259 0.3807 H 1 UNL11111111 0.1273 29 H -5.5099 0.9830 -1.6434 H 1 UNL11111111 0.1415 30 H -3.7912 0.8034 -2.0076 H 1 UNL11111111 0.1417 31 H -4.7910 -0.6274 -1.7364 H 1 UNL11111111 0.1468 32 H -5.3111 0.0150 1.9768 H 1 UNL11111111 0.1419 33 H -6.4012 0.4839 0.6697 H 1 UNL11111111 0.1427 34 H -5.6792 -1.1273 0.6793 H 1 UNL11111111 0.1463 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 1 4 1 5 4 5 1 6 5 6 2 7 5 7 am 8 7 8 1 9 8 9 1 10 9 10 1 11 10 11 1 12 11 12 1 13 11 13 1 14 1 14 1 15 1 15 1 16 2 16 1 17 2 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 7 21 1 22 8 22 1 23 8 23 1 24 9 24 1 25 9 25 1 26 10 26 1 27 10 27 1 28 11 28 1 29 12 29 1 30 12 30 1 31 12 31 1 32 13 32 1 33 13 33 1 34 13 34 1