@MOLECULE (5e)-15-chloro-16,18-dihydroxy-2-methyl-3,4,7,8,9,10,11,12-octahydro-2-benzazacyclohexadecine-1,13(2h,14h)-dione 52 53 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.7564 0.9679 1.2791 O.2 1 UNL111111111 -0.4857 2 C -0.0241 1.5310 0.5423 C.2 1 UNL111111111 0.5857 3 N 0.3216 2.7800 -0.0082 N.am 1 UNL111111111 -0.5013 4 C -0.3034 3.2061 -1.2680 C.3 1 UNL111111111 -0.2436 5 C -1.3957 1.0380 0.2936 C.ar 1 UNL111111111 -0.3748 6 C -2.5111 1.8121 0.6652 C.ar 1 UNL111111111 0.3939 7 O -2.3993 3.0441 1.1979 O.3 1 UNL111111111 -0.4570 8 C -3.8215 1.3614 0.4991 C.ar 1 UNL111111111 -0.3661 9 C -4.0047 0.0960 -0.0573 C.ar 1 UNL111111111 0.3685 10 O -5.2887 -0.2810 -0.2082 O.3 1 UNL111111111 -0.4410 11 C -2.9033 -0.6862 -0.4342 C.ar 1 UNL111111111 -0.2427 12 CL -3.1757 -2.2200 -1.1260 Cl 1 UNL111111111 -0.0633 13 C -1.5982 -0.2464 -0.2260 C.ar 1 UNL111111111 0.2109 14 C -0.4521 -1.1454 -0.5521 C.3 1 UNL111111111 -0.4191 15 C -0.4083 -2.3272 0.4041 C.2 1 UNL111111111 0.5041 16 O -1.1949 -2.4509 1.3035 O.2 1 UNL111111111 -0.4267 17 C 0.6853 -3.3362 0.1570 C.3 1 UNL111111111 -0.3829 18 C 1.9680 -2.9127 0.8870 C.3 1 UNL111111111 -0.2517 19 C 2.9338 -2.1455 -0.0262 C.3 1 UNL111111111 -0.2709 20 C 4.3250 -2.0634 0.6183 C.3 1 UNL111111111 -0.2646 21 C 5.3693 -1.4485 -0.3255 C.3 1 UNL111111111 -0.2669 22 C 5.4611 0.0802 -0.2005 C.3 1 UNL111111111 -0.2765 23 C 4.2822 0.7787 -0.7960 C.2 1 UNL111111111 -0.1449 24 C 3.8393 1.9538 -0.3391 C.2 1 UNL111111111 -0.1791 25 C 2.6697 2.6617 -0.9408 C.3 1 UNL111111111 -0.3082 26 C 1.7233 3.2032 0.1559 C.3 1 UNL111111111 -0.0713 27 H -1.4047 3.1560 -1.1970 H 1 UNL111111111 0.1603 28 H -0.0376 4.2558 -1.4808 H 1 UNL111111111 0.1496 29 H 0.0079 2.5912 -2.1289 H 1 UNL111111111 0.1361 30 H 1.7442 4.3144 0.1698 H 1 UNL111111111 0.1358 31 H 2.0702 2.8678 1.1658 H 1 UNL111111111 0.1759 32 H -1.4510 3.3524 1.2591 H 1 UNL111111111 0.3547 33 H -4.6687 1.9716 0.8041 H 1 UNL111111111 0.2075 34 H -5.3916 -1.2181 -0.5245 H 1 UNL111111111 0.3421 35 H -0.5126 -1.5056 -1.6018 H 1 UNL111111111 0.1860 36 H 0.5313 -0.6230 -0.4869 H 1 UNL111111111 0.1955 37 H 0.3494 -4.3252 0.5371 H 1 UNL111111111 0.1700 38 H 0.8689 -3.4829 -0.9217 H 1 UNL111111111 0.1570 39 H 1.7225 -2.2961 1.7770 H 1 UNL111111111 0.1606 40 H 2.4699 -3.8142 1.2892 H 1 UNL111111111 0.1411 41 H 3.0055 -2.6371 -1.0128 H 1 UNL111111111 0.1313 42 H 2.5518 -1.1228 -0.2117 H 1 UNL111111111 0.1448 43 H 4.2660 -1.4780 1.5560 H 1 UNL111111111 0.1474 44 H 4.6561 -3.0767 0.9164 H 1 UNL111111111 0.1306 45 H 6.3626 -1.8844 -0.0995 H 1 UNL111111111 0.1315 46 H 5.1571 -1.7327 -1.3725 H 1 UNL111111111 0.1361 47 H 5.5896 0.3578 0.8662 H 1 UNL111111111 0.1504 48 H 6.3841 0.4355 -0.7089 H 1 UNL111111111 0.1445 49 H 3.8157 0.2704 -1.6368 H 1 UNL111111111 0.1411 50 H 4.3079 2.4604 0.5018 H 1 UNL111111111 0.1478 51 H 3.0285 3.4954 -1.5779 H 1 UNL111111111 0.1471 52 H 2.1166 1.9910 -1.6278 H 1 UNL111111111 0.1505 @BOND 1 1 2 2 2 2 3 am 3 2 5 1 4 3 4 1 5 3 26 1 6 4 27 1 7 4 28 1 8 4 29 1 9 5 6 ar 10 5 13 ar 11 6 7 1 12 6 8 ar 13 7 32 1 14 8 9 ar 15 8 33 1 16 9 10 1 17 9 11 ar 18 10 34 1 19 11 12 1 20 11 13 ar 21 13 14 1 22 14 15 1 23 14 35 1 24 14 36 1 25 15 16 2 26 15 17 1 27 17 18 1 28 17 37 1 29 17 38 1 30 18 19 1 31 18 39 1 32 18 40 1 33 19 20 1 34 19 41 1 35 19 42 1 36 20 21 1 37 20 43 1 38 20 44 1 39 21 22 1 40 21 45 1 41 21 46 1 42 22 23 1 43 22 47 1 44 22 48 1 45 23 24 2 46 23 49 1 47 24 25 1 48 24 50 1 49 25 26 1 50 25 51 1 51 25 52 1 52 26 30 1 53 26 31 1