@MOLECULE (e)-n~5~-[amino(nitroamino)methylene]-n-(4-nitrophenyl)-l-ornithinamide 41 41 0 0 0 SMALL USER_CHARGES @ATOM 1 O 0.6526 2.0549 0.6772 O.2 1 UNL111 -0.3629 2 O 7.0832 -1.4767 -0.6281 O.2 1 UNL111 -0.1516 3 O 7.2246 0.6575 -0.4168 O.2 1 UNL111 -0.2042 4 O -3.5334 -2.1243 -0.1185 O.2 1 UNL111 -0.2287 5 O -5.4184 -2.6561 0.8397 O.2 1 UNL111 -0.0558 6 N -1.4864 -0.5156 1.5957 N.3 1 UNL111 -0.8749 7 N 1.0292 -0.1925 0.4562 N.am 1 UNL111 -0.7804 8 N -4.7569 1.2129 -0.2580 N.pl3 1 UNL111 -0.5835 9 N -5.3709 -0.9936 -0.6173 N.pl3 1 UNL111 -0.5675 10 N 6.5842 -0.3828 -0.4157 N.pl3 1 UNL111 -0.0862 11 N -3.7717 -0.0528 -2.1046 N.pl3 1 UNL111 -1.1786 12 N -4.7199 -1.9808 0.1174 N.pl3 1 UNL111 0.2093 13 C -2.1148 1.8604 0.9610 C.3 1 UNL111 -0.7750 14 C -1.2906 0.5989 0.6499 C.3 1 UNL111 0.4108 15 C -2.6145 2.5583 -0.3101 C.3 1 UNL111 -0.1455 16 C -4.1479 2.5103 -0.4664 C.3 1 UNL111 -0.3325 17 C 0.2177 0.9312 0.6306 C.2 1 UNL111 0.3536 18 C 2.4194 -0.1800 0.2965 C.ar 1 UNL111 0.5707 19 C 3.0568 -1.4384 0.1733 C.ar 1 UNL111 -0.4148 20 C 3.1802 0.9992 0.2177 C.ar 1 UNL111 -0.4470 21 C 4.4193 -1.4985 -0.0612 C.ar 1 UNL111 -0.3704 22 C 4.5460 0.9320 -0.0052 C.ar 1 UNL111 -0.3519 23 C 5.1633 -0.3147 -0.1539 C.ar 1 UNL111 0.4883 24 C -4.5507 0.1638 -0.9757 C.cat 1 UNL111 0.8203 25 H -1.5068 2.5718 1.5616 H 1 UNL111 0.2599 26 H -2.9745 1.6022 1.6124 H 1 UNL111 0.2999 27 H -1.5496 0.2170 -0.3767 H 1 UNL111 0.1095 28 H -2.1136 2.1574 -1.2075 H 1 UNL111 0.0682 29 H -2.3052 3.6268 -0.2862 H 1 UNL111 0.1520 30 H -4.6181 3.1757 0.3040 H 1 UNL111 0.2495 31 H -4.4367 2.9330 -1.4568 H 1 UNL111 0.1809 32 H -1.5246 -0.2083 2.5556 H 1 UNL111 0.3684 33 H -2.3225 -1.0356 1.3739 H 1 UNL111 0.3322 34 H 0.5687 -1.1036 0.5707 H 1 UNL111 0.4402 35 H 2.4785 -2.3561 0.2546 H 1 UNL111 0.2675 36 H 2.7053 1.9784 0.3313 H 1 UNL111 0.2945 37 H 4.9214 -2.4664 -0.1770 H 1 UNL111 0.3124 38 H 5.1425 1.8503 -0.0665 H 1 UNL111 0.2852 39 H -6.3101 -0.7484 -0.2452 H 1 UNL111 0.4002 40 H -3.6484 -0.9953 -2.4360 H 1 UNL111 0.5134 41 H -3.0034 0.5665 -2.2788 H 1 UNL111 0.5244 @BOND 1 40 11 1 2 41 11 1 3 11 24 1 4 31 16 1 5 28 15 1 6 24 9 1 7 24 8 2 8 2 10 2 9 9 39 1 10 9 12 1 11 16 15 1 12 16 8 1 13 16 30 1 14 3 10 2 15 10 23 1 16 27 14 1 17 15 29 1 18 15 13 1 19 37 21 1 20 23 21 ar 21 23 22 ar 22 4 12 2 23 38 22 1 24 21 19 ar 25 22 20 ar 26 12 5 2 27 19 35 1 28 19 18 ar 29 20 18 ar 30 20 36 1 31 18 7 1 32 7 34 1 33 7 17 am 34 17 14 1 35 17 1 2 36 14 13 1 37 14 6 1 38 13 25 1 39 13 26 1 40 33 6 1 41 6 32 1