@MOLECULE (1S,2S)-N-isopentyl-2-methyl-cyclobutanamine 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.3090 0.1573 0.2374 C.3 1 UNL11111111 -0.0571 2 C 3.5886 -1.2497 0.7801 C.3 1 UNL11111111 -0.4536 3 C 4.4810 0.6179 -0.6396 C.3 1 UNL11111111 -0.4560 4 C 2.0065 0.1772 -0.5831 C.3 1 UNL11111111 -0.3030 5 C 0.7739 0.1527 0.3372 C.3 1 UNL11111111 -0.1049 6 N -0.4366 -0.0697 -0.4882 N.3 1 UNL11111111 -0.5585 7 C -1.6537 -0.1048 0.3130 C.3 1 UNL11111111 0.0457 8 H -1.5469 -0.8579 1.1162 H 1 UNL11111111 0.1417 9 C -2.9447 -0.3079 -0.5588 C.3 1 UNL11111111 -0.1060 10 H -2.7373 -0.2585 -1.6415 H 1 UNL11111111 0.1421 11 C -3.7343 -1.5546 -0.2221 C.3 1 UNL11111111 -0.4492 12 C -3.5252 1.0203 0.0077 C.3 1 UNL11111111 -0.2933 13 C -2.2341 1.2604 0.8252 C.3 1 UNL11111111 -0.3478 14 H 3.2090 0.8629 1.0971 H 1 UNL11111111 0.1275 15 H 4.4804 -1.2616 1.4148 H 1 UNL11111111 0.1401 16 H 2.7509 -1.6241 1.3786 H 1 UNL11111111 0.1439 17 H 3.7515 -1.9656 -0.0333 H 1 UNL11111111 0.1466 18 H 4.5811 -0.0063 -1.5341 H 1 UNL11111111 0.1459 19 H 4.3504 1.6534 -0.9703 H 1 UNL11111111 0.1412 20 H 5.4292 0.5640 -0.0940 H 1 UNL11111111 0.1430 21 H 1.9764 1.0725 -1.2297 H 1 UNL11111111 0.1358 22 H 1.9738 -0.6908 -1.2709 H 1 UNL11111111 0.1592 23 H 0.8521 -0.6892 1.0603 H 1 UNL11111111 0.1420 24 H 0.7185 1.0881 0.9333 H 1 UNL11111111 0.1110 25 H -0.4982 0.6092 -1.2436 H 1 UNL11111111 0.2578 26 H -3.9336 -1.6387 0.8524 H 1 UNL11111111 0.1449 27 H -4.7022 -1.5637 -0.7378 H 1 UNL11111111 0.1460 28 H -3.1873 -2.4576 -0.5252 H 1 UNL11111111 0.1527 29 H -3.7332 1.7783 -0.7500 H 1 UNL11111111 0.1373 30 H -4.4258 0.8957 0.6133 H 1 UNL11111111 0.1427 31 H -2.3793 1.3088 1.9046 H 1 UNL11111111 0.1416 32 H -1.6618 2.1375 0.5210 H 1 UNL11111111 0.1407 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 7 8 1 8 7 9 1 9 9 10 1 10 9 11 1 11 9 12 1 12 12 13 1 13 7 13 1 14 1 14 1 15 2 15 1 16 2 16 1 17 2 17 1 18 3 18 1 19 3 19 1 20 3 20 1 21 4 21 1 22 4 22 1 23 5 23 1 24 5 24 1 25 6 25 1 26 11 26 1 27 11 27 1 28 11 28 1 29 12 29 1 30 12 30 1 31 13 31 1 32 13 32 1