@MOLECULE 8-chloro-n'-[3-(4-pyridinyl)propanoyl]dibenzo[b,f][1,4]oxazepine-10(11h)-carbohydrazide 49 52 0 0 0 SMALL GASTEIGER @ATOM 1 CL 3.3898 -4.5591 0.5065 Cl 1 UNL111111111 -0.0738 2 O 4.7830 0.9630 -0.6633 O.3 1 UNL111111111 -0.3174 3 O 0.5303 -0.6640 1.0138 O.2 1 UNL111111111 -0.4983 4 O -2.6976 0.2266 -1.9869 O.2 1 UNL111111111 -0.5332 5 N 1.8576 0.1296 -0.7138 N.am 1 UNL111111111 -0.4731 6 N -0.4587 0.7309 -0.5427 N.am 1 UNL111111111 -0.3776 7 N -1.6959 0.4019 0.0307 N.am 1 UNL111111111 -0.4553 8 N -8.9908 -0.1779 1.1253 N.ar 1 UNL111111111 -0.3789 9 C 2.1698 1.4537 -1.2939 C.3 1 UNL111111111 -0.0603 10 C 2.8763 2.3582 -0.3283 C.ar 1 UNL111111111 -0.1340 11 C 2.9532 -0.6965 -0.3352 C.ar 1 UNL111111111 0.1501 12 C 4.1948 2.0255 -0.0130 C.ar 1 UNL111111111 0.2088 13 C 4.3033 -0.2880 -0.3397 C.ar 1 UNL111111111 0.1290 14 C 0.6374 -0.0240 -0.0067 C.2 1 UNL111111111 0.6617 15 C 2.3330 3.5107 0.2303 C.ar 1 UNL111111111 -0.1005 16 C 2.6936 -2.0530 -0.0549 C.ar 1 UNL111111111 -0.1860 17 C 4.9953 2.8048 0.8151 C.ar 1 UNL111111111 -0.2073 18 C 5.3542 -1.1867 -0.1214 C.ar 1 UNL111111111 -0.1525 19 C 3.1217 4.3207 1.0512 C.ar 1 UNL111111111 -0.1788 20 C -5.2734 -0.0633 -1.0249 C.3 1 UNL111111111 -0.2782 21 C -4.1190 0.1061 -0.0275 C.3 1 UNL111111111 -0.3395 22 C 3.7491 -2.9206 0.1729 C.ar 1 UNL111111111 0.0284 23 C 4.4419 3.9739 1.3372 C.ar 1 UNL111111111 -0.1024 24 C 5.0807 -2.5238 0.1355 C.ar 1 UNL111111111 -0.1683 25 C -6.5764 -0.1031 -0.2901 C.ar 1 UNL111111111 0.0818 26 C -2.8114 0.2286 -0.7785 C.2 1 UNL111111111 0.5799 27 C -7.0832 -1.3148 0.1857 C.ar 1 UNL111111111 -0.2685 28 C -7.2973 1.0689 -0.0530 C.ar 1 UNL111111111 -0.2713 29 C -8.2923 -1.3050 0.8909 C.ar 1 UNL111111111 0.0605 30 C -8.4976 0.9866 0.6627 C.ar 1 UNL111111111 0.0608 31 H 2.8295 1.2753 -2.1879 H 1 UNL111111111 0.1795 32 H 1.2456 1.9306 -1.6882 H 1 UNL111111111 0.1598 33 H 1.3001 3.7872 0.0218 H 1 UNL111111111 0.1604 34 H 1.6622 -2.4169 -0.0128 H 1 UNL111111111 0.1984 35 H 6.0191 2.5116 1.0307 H 1 UNL111111111 0.1745 36 H 6.3792 -0.8193 -0.1523 H 1 UNL111111111 0.1789 37 H -5.1157 -0.9819 -1.6310 H 1 UNL111111111 0.1740 38 H -5.2618 0.7528 -1.7794 H 1 UNL111111111 0.1742 39 H -4.0926 -0.7606 0.6689 H 1 UNL111111111 0.1773 40 H -4.2942 1.0052 0.6009 H 1 UNL111111111 0.1750 41 H 2.7075 5.2375 1.4674 H 1 UNL111111111 0.1563 42 H 5.0531 4.6205 1.9657 H 1 UNL111111111 0.1551 43 H -0.5342 0.7874 -1.5722 H 1 UNL111111111 0.3266 44 H 5.8842 -3.2372 0.3090 H 1 UNL111111111 0.1765 45 H -1.6753 0.3860 1.0480 H 1 UNL111111111 0.3490 46 H -6.5579 -2.2499 0.0136 H 1 UNL111111111 0.1703 47 H -6.9404 2.0266 -0.4161 H 1 UNL111111111 0.1682 48 H -8.7331 -2.2262 1.2887 H 1 UNL111111111 0.1703 49 H -9.0976 1.8778 0.8801 H 1 UNL111111111 0.1696 @BOND 1 1 22 1 2 2 12 1 3 2 13 1 4 3 14 2 5 4 26 2 6 5 9 1 7 5 11 1 8 5 14 am 9 6 7 1 10 6 14 am 11 6 43 1 12 7 26 am 13 7 45 1 14 8 29 ar 15 8 30 ar 16 9 10 1 17 9 31 1 18 9 32 1 19 10 12 ar 20 10 15 ar 21 11 13 ar 22 11 16 ar 23 12 17 ar 24 13 18 ar 25 15 19 ar 26 15 33 1 27 16 22 ar 28 16 34 1 29 17 23 ar 30 17 35 1 31 18 24 ar 32 18 36 1 33 19 23 ar 34 19 41 1 35 20 21 1 36 20 25 1 37 20 37 1 38 20 38 1 39 21 26 1 40 21 39 1 41 21 40 1 42 22 24 ar 43 23 42 1 44 24 44 1 45 25 27 ar 46 25 28 ar 47 27 29 ar 48 27 46 1 49 28 30 ar 50 28 47 1 51 29 48 1 52 30 49 1