@MOLECULE n,n''-{[(2s)-3-amino-1,2-propanediyl]bis(oxymethylene-3,1-phenylene)}di(2-thiophenecarboximidamide) 65 68 0 0 0 SMALL GASTEIGER @ATOM 1 N 7.1947 -1.6086 1.9830 N.2 1 UNL111111111 -0.5733 2 C 7.2767 -0.9077 0.9136 C.2 1 UNL111111111 0.4363 3 C 8.4420 -1.0320 0.0316 C.ar 1 UNL111111111 -0.2238 4 S 8.3353 -1.8141 -1.5207 S.2 1 UNL111111111 0.2883 5 C 10.0227 -1.5690 -1.8324 C.ar 1 UNL111111111 -0.2730 6 C 10.6247 -0.9282 -0.7872 C.ar 1 UNL111111111 -0.1789 7 C 9.7215 -0.6236 0.2849 C.ar 1 UNL111111111 -0.1164 8 N 6.3540 0.0736 0.4730 N.pl3 1 UNL111111111 -0.6092 9 C 4.9788 0.0605 0.7740 C.ar 1 UNL111111111 0.2441 10 C 4.2883 1.2846 0.7247 C.ar 1 UNL111111111 -0.2812 11 C 4.2925 -1.1278 1.0633 C.ar 1 UNL111111111 -0.2729 12 C 2.9230 -1.0840 1.3080 C.ar 1 UNL111111111 -0.0806 13 C 2.2312 0.1227 1.2604 C.ar 1 UNL111111111 -0.1956 14 C 2.9191 1.3014 0.9655 C.ar 1 UNL111111111 0.0495 15 C 2.1538 2.5926 0.8931 C.3 1 UNL111111111 -0.0673 16 O 1.0164 2.2649 0.1054 O.3 1 UNL111111111 -0.3844 17 C 0.0754 3.3158 -0.0450 C.3 1 UNL111111111 0.0820 18 C -0.4247 3.1496 -1.4954 C.3 1 UNL111111111 -0.1222 19 N 0.6152 3.6901 -2.4020 N.3 1 UNL111111111 -0.6485 20 C -1.0708 3.0892 0.9596 C.3 1 UNL111111111 -0.1084 21 O -1.8131 2.0212 0.3954 O.3 1 UNL111111111 -0.3625 22 C -3.0479 1.7680 1.0568 C.3 1 UNL111111111 -0.0675 23 C -3.5375 0.5173 0.3821 C.ar 1 UNL111111111 0.0167 24 C -2.8228 -0.6693 0.5526 C.ar 1 UNL111111111 -0.1743 25 C -3.2459 -1.8317 -0.0883 C.ar 1 UNL111111111 -0.1136 26 C -4.3791 -1.8180 -0.8949 C.ar 1 UNL111111111 -0.2133 27 C -4.6654 0.5563 -0.4317 C.ar 1 UNL111111111 -0.2195 28 C -5.0871 -0.6195 -1.0690 C.ar 1 UNL111111111 0.2009 29 N -6.1596 -0.5620 -1.9776 N.2 1 UNL111111111 -0.5100 30 C -7.3802 -0.8709 -1.6677 C.2 1 UNL111111111 0.4185 31 N -8.3081 -0.9248 -2.7091 N.pl3 1 UNL111111111 -0.6137 32 C -7.8931 -1.2306 -0.3426 C.ar 1 UNL111111111 -0.2751 33 S -8.0281 -0.0600 0.9368 S.2 1 UNL111111111 0.2773 34 C -8.5875 -1.2549 2.0615 C.ar 1 UNL111111111 -0.2625 35 C -8.6594 -2.4840 1.4709 C.ar 1 UNL111111111 -0.1792 36 C -8.2632 -2.4724 0.0924 C.ar 1 UNL111111111 -0.1132 37 H 6.4189 -1.5314 2.6172 H 1 UNL111111111 0.2849 38 H 6.6825 0.7912 -0.1619 H 1 UNL111111111 0.3233 39 H 10.0433 -0.1321 1.1926 H 1 UNL111111111 0.1714 40 H 10.4884 -1.9000 -2.7436 H 1 UNL111111111 0.1755 41 H 11.6716 -0.6681 -0.7410 H 1 UNL111111111 0.1643 42 H 4.8202 2.2030 0.4966 H 1 UNL111111111 0.1619 43 H 4.8083 -2.0847 1.0587 H 1 UNL111111111 0.1687 44 H 2.3859 -2.0075 1.5252 H 1 UNL111111111 0.1521 45 H 1.1541 0.1525 1.4244 H 1 UNL111111111 0.1744 46 H 1.8403 2.9299 1.8988 H 1 UNL111111111 0.1278 47 H 2.7189 3.4029 0.3966 H 1 UNL111111111 0.1304 48 H 0.5430 4.3119 0.1045 H 1 UNL111111111 0.1350 49 H -0.6595 2.0764 -1.6842 H 1 UNL111111111 0.1512 50 H -1.3645 3.7209 -1.6455 H 1 UNL111111111 0.1494 51 H -0.6853 2.7823 1.9468 H 1 UNL111111111 0.1276 52 H -1.6985 3.9888 1.0640 H 1 UNL111111111 0.1175 53 H 1.4993 3.2289 -2.2381 H 1 UNL111111111 0.2532 54 H 0.3619 3.5573 -3.3681 H 1 UNL111111111 0.2459 55 H -2.8813 1.6146 2.1386 H 1 UNL111111111 0.1238 56 H -3.7239 2.6299 0.9142 H 1 UNL111111111 0.1229 57 H -1.9248 -0.6757 1.1670 H 1 UNL111111111 0.1609 58 H -5.2064 1.4843 -0.5959 H 1 UNL111111111 0.1644 59 H -2.6841 -2.7561 0.0388 H 1 UNL111111111 0.1511 60 H -4.7119 -2.7198 -1.4021 H 1 UNL111111111 0.1632 61 H -8.0110 -0.5947 -3.6118 H 1 UNL111111111 0.3093 62 H -9.2737 -0.7952 -2.4928 H 1 UNL111111111 0.2966 63 H -8.2583 -3.3664 -0.5165 H 1 UNL111111111 0.1727 64 H -8.8301 -1.0086 3.0806 H 1 UNL111111111 0.1787 65 H -8.9761 -3.3910 1.9649 H 1 UNL111111111 0.1682 @BOND 1 1 2 2 2 1 37 1 3 2 3 1 4 2 8 1 5 3 4 ar 6 3 7 ar 7 4 5 ar 8 5 6 ar 9 5 40 1 10 6 7 ar 11 6 41 1 12 7 39 1 13 8 9 1 14 8 38 1 15 9 10 ar 16 9 11 ar 17 10 14 ar 18 10 42 1 19 11 12 ar 20 11 43 1 21 12 13 ar 22 12 44 1 23 13 14 ar 24 13 45 1 25 14 15 1 26 15 16 1 27 15 46 1 28 15 47 1 29 16 17 1 30 17 18 1 31 17 20 1 32 17 48 1 33 18 19 1 34 18 49 1 35 18 50 1 36 19 53 1 37 19 54 1 38 20 21 1 39 20 51 1 40 20 52 1 41 21 22 1 42 22 23 1 43 22 55 1 44 22 56 1 45 23 24 ar 46 23 27 ar 47 24 25 ar 48 24 57 1 49 25 26 ar 50 25 59 1 51 26 28 ar 52 26 60 1 53 27 28 ar 54 27 58 1 55 28 29 1 56 29 30 2 57 30 31 1 58 30 32 1 59 31 61 1 60 31 62 1 61 32 33 ar 62 32 36 ar 63 33 34 ar 64 34 35 ar 65 34 64 1 66 35 36 ar 67 35 65 1 68 36 63 1