@MOLECULE cis-3,7-dimethyl-2,6-octadienenitrile 26 25 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.1879 1.2568 0.4645 C.3 1 UNL1111111111 -0.4661 2 N -1.0772 2.7046 -0.2071 N.1 1 UNL1111111111 -0.2885 3 C 3.9235 -0.3268 -0.4512 C.3 1 UNL1111111111 -0.4593 4 C 2.5323 -0.1362 0.0609 C.2 1 UNL1111111111 0.0832 5 C 1.6759 -1.1645 0.1371 C.2 1 UNL1111111111 -0.2637 6 C 0.2662 -1.0517 0.6163 C.3 1 UNL1111111111 -0.2442 7 C -0.6760 -0.9213 -0.5987 C.3 1 UNL1111111111 -0.3140 8 C -2.0700 -0.6455 -0.1337 C.2 1 UNL1111111111 0.1653 9 C -2.5221 0.6001 0.1085 C.2 1 UNL1111111111 -0.3000 10 C -2.9431 -1.8357 0.0558 C.3 1 UNL1111111111 -0.4734 11 C -1.7260 1.7542 -0.0666 C.1 1 UNL1111111111 0.1535 12 H 3.0199 1.9606 0.3367 H 1 UNL1111111111 0.1552 13 H 1.3471 1.6540 -0.1288 H 1 UNL1111111111 0.1739 14 H 4.6668 -0.0236 0.2998 H 1 UNL1111111111 0.1571 15 H 4.1417 -1.3676 -0.7213 H 1 UNL1111111111 0.1495 16 H 4.0981 0.2838 -1.3493 H 1 UNL1111111111 0.1590 17 H 1.9679 -2.1654 -0.1693 H 1 UNL1111111111 0.1470 18 H -0.0110 -1.9382 1.2206 H 1 UNL1111111111 0.1400 19 H 0.1346 -0.1811 1.2913 H 1 UNL1111111111 0.1503 20 H -0.3041 -0.1118 -1.2639 H 1 UNL1111111111 0.1681 21 H -0.6241 -1.8422 -1.2124 H 1 UNL1111111111 0.1577 22 H -3.5416 0.7878 0.4588 H 1 UNL1111111111 0.1862 23 H -2.4302 -2.6290 0.6220 H 1 UNL1111111111 0.1699 24 H -3.8759 -1.6089 0.5910 H 1 UNL1111111111 0.1628 25 H -3.2290 -2.2722 -0.9155 H 1 UNL1111111111 0.1715 26 H 1.8817 1.3100 1.5193 H 1 UNL1111111111 0.1592 @BOND 1 1 4 1 2 1 12 1 3 1 13 1 4 1 26 1 5 2 11 3 6 3 4 1 7 3 14 1 8 3 15 1 9 3 16 1 10 4 5 2 11 5 6 1 12 5 17 1 13 6 7 1 14 6 18 1 15 6 19 1 16 7 8 1 17 7 20 1 18 7 21 1 19 8 9 2 20 8 10 1 21 9 11 1 22 9 22 1 23 10 23 1 24 10 24 1 25 10 25 1