@MOLECULE 2-(diethylamino)pentanenitrile 29 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C -3.7731 0.7302 -0.9380 C.3 1 UNL11111111 -0.8018 2 C -2.7039 0.4159 0.1068 C.3 1 UNL11111111 -0.0869 3 C -1.3256 0.3037 -0.5533 C.3 1 UNL11111111 -0.3285 4 C -0.2391 -0.0387 0.4958 C.3 1 UNL11111111 -0.2106 5 C -0.4216 -1.4190 0.9475 C.1 1 UNL11111111 0.0999 6 N -0.5784 -2.5044 1.3130 N.1 1 UNL11111111 -0.2068 7 N 1.1612 0.1061 0.0389 N.3 1 UNL11111111 -0.2799 8 C 1.4358 -0.6144 -1.2290 C.3 1 UNL11111111 -0.1061 9 C 2.9190 -1.0035 -1.2669 C.3 1 UNL11111111 -0.8433 10 C 1.5870 1.5252 -0.0203 C.3 1 UNL11111111 -0.1022 11 C 1.8132 2.0599 1.3992 C.3 1 UNL11111111 -0.8297 12 H -3.5677 1.6744 -1.4548 H 1 UNL11111111 0.2115 13 H -3.8357 -0.0572 -1.6987 H 1 UNL11111111 0.2343 14 H -4.7642 0.8174 -0.4779 H 1 UNL11111111 0.2317 15 H -2.6958 1.2019 0.8849 H 1 UNL11111111 0.1211 16 H -2.9548 -0.5290 0.6299 H 1 UNL11111111 0.1485 17 H -1.0665 1.2550 -1.0552 H 1 UNL11111111 0.1658 18 H -1.3478 -0.4607 -1.3526 H 1 UNL11111111 0.1682 19 H -0.3702 0.6445 1.3903 H 1 UNL11111111 0.2648 20 H 1.1657 -0.0199 -2.1265 H 1 UNL11111111 0.1037 21 H 0.8216 -1.5430 -1.2629 H 1 UNL11111111 0.2165 22 H 3.5728 -0.1335 -1.3829 H 1 UNL11111111 0.2471 23 H 3.2091 -1.5013 -0.3304 H 1 UNL11111111 0.2770 24 H 3.1219 -1.6936 -2.0921 H 1 UNL11111111 0.2420 25 H 2.5486 1.5748 -0.5822 H 1 UNL11111111 0.1774 26 H 0.8674 2.1694 -0.5681 H 1 UNL11111111 0.1321 27 H 0.8746 2.2295 1.9362 H 1 UNL11111111 0.2511 28 H 2.4035 1.3452 1.9900 H 1 UNL11111111 0.2741 29 H 2.3597 3.0081 1.3773 H 1 UNL11111111 0.2289 @BOND 1 20 8 1 2 24 9 1 3 13 1 1 4 12 1 1 5 22 9 1 6 18 3 1 7 9 8 1 8 9 23 1 9 21 8 1 10 8 7 1 11 17 3 1 12 1 14 1 13 1 2 1 14 25 10 1 15 26 10 1 16 3 2 1 17 3 4 1 18 10 7 1 19 10 11 1 20 7 4 1 21 2 16 1 22 2 15 1 23 4 5 1 24 4 19 1 25 5 6 3 26 29 11 1 27 11 27 1 28 11 28 1