@MOLECULE (4s,4'r)-4,4'-[(e)-1,2-diazenediyl]bis(4-cyanopentanoic acid) 36 35 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.8987 1.3064 0.9975 O.3 1 UNL1111111111 -0.5611 2 O 5.0509 -1.1376 -0.9545 O.3 1 UNL1111111111 -0.5608 3 O -5.0151 0.4593 -1.0632 O.2 1 UNL1111111111 -0.4976 4 O 4.7837 -0.7517 1.2270 O.2 1 UNL1111111111 -0.4972 5 N -0.1966 -0.4784 0.2816 N.2 1 UNL1111111111 -0.1729 6 N 0.2004 0.5165 -0.3406 N.2 1 UNL1111111111 -0.1732 7 N -1.5810 -3.3724 1.2014 N.1 1 UNL1111111111 -0.2176 8 N 1.6642 3.3667 -1.2821 N.1 1 UNL1111111111 -0.2189 9 C -1.1152 -1.3969 -0.4577 C.3 1 UNL1111111111 0.1968 10 C 1.1198 1.4330 0.4017 C.3 1 UNL1111111111 0.1962 11 C -2.4448 -0.6961 -0.8225 C.3 1 UNL1111111111 -0.2827 12 C 2.4257 0.7180 0.8190 C.3 1 UNL1111111111 -0.2835 13 C -3.1711 -0.1533 0.4070 C.3 1 UNL1111111111 -0.3520 14 C 3.1958 0.1635 -0.3782 C.3 1 UNL1111111111 -0.3524 15 C -0.4456 -1.9617 -1.7197 C.3 1 UNL1111111111 -0.4661 16 C 0.4248 2.0334 1.6336 C.3 1 UNL1111111111 -0.4655 17 C -1.3703 -2.4978 0.4774 C.1 1 UNL1111111111 0.0828 18 C 1.4191 2.5100 -0.5475 C.1 1 UNL1111111111 0.0833 19 C -4.4323 0.5307 -0.0149 C.2 1 UNL1111111111 0.6468 20 C 4.3921 -0.5951 0.1018 C.2 1 UNL1111111111 0.6464 21 H -2.2388 0.1275 -1.5426 H 1 UNL1111111111 0.1826 22 H -3.1031 -1.4015 -1.3752 H 1 UNL1111111111 0.1799 23 H 2.1827 -0.1030 1.5325 H 1 UNL1111111111 0.1873 24 H 3.0682 1.4158 1.3975 H 1 UNL1111111111 0.1765 25 H -2.5277 0.5461 0.9866 H 1 UNL1111111111 0.1889 26 H -3.4173 -0.9680 1.1276 H 1 UNL1111111111 0.1934 27 H 3.5178 0.9769 -1.0693 H 1 UNL1111111111 0.1939 28 H 2.5569 -0.4972 -1.0063 H 1 UNL1111111111 0.1884 29 H 0.5031 -2.4642 -1.4872 H 1 UNL1111111111 0.1689 30 H -1.0880 -2.6958 -2.2235 H 1 UNL1111111111 0.1716 31 H -0.2250 -1.1636 -2.4441 H 1 UNL1111111111 0.1794 32 H 1.0634 2.7698 2.1388 H 1 UNL1111111111 0.1711 33 H -0.5108 2.5428 1.3656 H 1 UNL1111111111 0.1694 34 H 0.1748 1.2534 2.3683 H 1 UNL1111111111 0.1795 35 H -5.7422 1.7767 0.7824 H 1 UNL1111111111 0.3591 36 H 5.8582 -1.6497 -0.6990 H 1 UNL1111111111 0.3593 @BOND 1 1 19 1 2 1 35 1 3 2 20 1 4 2 36 1 5 3 19 2 6 4 20 2 7 5 6 2 8 5 9 1 9 6 10 1 10 7 17 3 11 8 18 3 12 9 11 1 13 9 15 1 14 9 17 1 15 10 12 1 16 10 16 1 17 10 18 1 18 11 13 1 19 11 21 1 20 11 22 1 21 12 14 1 22 12 23 1 23 12 24 1 24 13 19 1 25 13 25 1 26 13 26 1 27 14 20 1 28 14 27 1 29 14 28 1 30 15 29 1 31 15 30 1 32 15 31 1 33 16 32 1 34 16 33 1 35 16 34 1