@MOLECULE (17beta)-3-oxoestr-4-en-17-yl (2-chloroethyl)nitrosocarbamate 57 60 0 0 0 SMALL GASTEIGER @ATOM 1 CL -8.1145 0.3711 0.6156 Cl 1 UNL1111111111 -0.1426 2 O -2.1843 0.1677 -0.2631 O.3 1 UNL1111111111 -0.3695 3 O 8.3311 -0.0426 0.9409 O.2 1 UNL1111111111 -0.4649 4 O -3.7636 1.3357 0.8964 O.2 1 UNL1111111111 -0.5136 5 O -4.7012 -2.4007 -1.3505 O.2 1 UNL1111111111 -0.2096 6 N -4.3127 -0.6420 -0.1484 N.am 1 UNL1111111111 -0.4445 7 N -3.9177 -1.5606 -1.0583 N.2 1 UNL1111111111 0.2586 8 C 0.6686 -0.4257 0.1770 C.3 1 UNL1111111111 -0.1312 9 C 0.0639 0.6876 -0.7173 C.3 1 UNL1111111111 0.0544 10 C 2.1174 -0.7678 -0.1909 C.3 1 UNL1111111111 -0.1312 11 C 3.0133 0.4844 -0.2244 C.3 1 UNL1111111111 -0.1153 12 C 1.0111 1.8956 -0.8404 C.3 1 UNL1111111111 -0.2920 13 C -1.1757 1.1368 0.1107 C.3 1 UNL1111111111 0.1088 14 C 0.4584 0.0741 1.6224 C.3 1 UNL1111111111 -0.2749 15 C 2.4274 1.4752 -1.2464 C.3 1 UNL1111111111 -0.2811 16 C 4.4739 0.1277 -0.5979 C.3 1 UNL1111111111 -0.1557 17 C -0.8088 0.9485 1.5880 C.3 1 UNL1111111111 -0.3172 18 C 2.6912 -1.7944 0.7928 C.3 1 UNL1111111111 -0.2770 19 C -0.3361 0.1682 -2.0935 C.3 1 UNL1111111111 -0.4568 20 C 4.0870 -2.2244 0.3378 C.3 1 UNL1111111111 -0.3032 21 C 5.0004 -1.0493 0.1798 C.2 1 UNL1111111111 0.1227 22 C 5.3603 1.3727 -0.3808 C.3 1 UNL1111111111 -0.2632 23 C 6.8417 1.0477 -0.5531 C.3 1 UNL1111111111 -0.3839 24 C 6.2584 -1.1055 0.6437 C.2 1 UNL1111111111 -0.3783 25 C 7.2431 -0.0402 0.4157 C.2 1 UNL1111111111 0.4948 26 C -3.4143 0.3959 0.2245 C.2 1 UNL1111111111 0.7205 27 C -5.6470 -0.6226 0.4891 C.3 1 UNL1111111111 -0.1159 28 C -6.5183 0.4539 -0.1541 C.3 1 UNL1111111111 -0.2050 29 H 0.0527 -1.3504 0.0377 H 1 UNL1111111111 0.1504 30 H 2.1080 -1.2199 -1.2147 H 1 UNL1111111111 0.1408 31 H 3.0123 0.9560 0.7867 H 1 UNL1111111111 0.1448 32 H 1.0572 2.4406 0.1227 H 1 UNL1111111111 0.1442 33 H 0.6086 2.6148 -1.5788 H 1 UNL1111111111 0.1409 34 H -1.5524 2.1430 -0.1424 H 1 UNL1111111111 0.1403 35 H 0.3493 -0.7689 2.3223 H 1 UNL1111111111 0.1399 36 H 1.3265 0.6569 1.9722 H 1 UNL1111111111 0.1403 37 H 2.4190 1.0226 -2.2552 H 1 UNL1111111111 0.1403 38 H 3.0661 2.3749 -1.3250 H 1 UNL1111111111 0.1386 39 H 4.5065 -0.1557 -1.6822 H 1 UNL1111111111 0.1559 40 H -0.6411 1.9212 2.0808 H 1 UNL1111111111 0.1524 41 H -1.6367 0.4763 2.1463 H 1 UNL1111111111 0.1625 42 H 2.7418 -1.3681 1.8130 H 1 UNL1111111111 0.1481 43 H 2.0244 -2.6738 0.8646 H 1 UNL1111111111 0.1428 44 H -0.8981 0.9186 -2.6607 H 1 UNL1111111111 0.1499 45 H -0.9764 -0.7235 -2.0245 H 1 UNL1111111111 0.1673 46 H 0.5419 -0.1107 -2.6863 H 1 UNL1111111111 0.1471 47 H 4.0231 -2.7644 -0.6325 H 1 UNL1111111111 0.1587 48 H 4.5010 -2.9644 1.0545 H 1 UNL1111111111 0.1573 49 H 5.1850 1.7831 0.6343 H 1 UNL1111111111 0.1494 50 H 5.0693 2.1748 -1.0850 H 1 UNL1111111111 0.1422 51 H 7.4658 1.9504 -0.3978 H 1 UNL1111111111 0.1723 52 H 7.0619 0.7111 -1.5858 H 1 UNL1111111111 0.1675 53 H 6.6369 -1.9552 1.2106 H 1 UNL1111111111 0.1796 54 H -5.5241 -0.4295 1.5838 H 1 UNL1111111111 0.1759 55 H -6.1138 -1.6333 0.3936 H 1 UNL1111111111 0.1762 56 H -6.6679 0.2995 -1.2345 H 1 UNL1111111111 0.1628 57 H -6.1250 1.4726 0.0202 H 1 UNL1111111111 0.1788 @BOND 1 1 28 1 2 2 13 1 3 2 26 1 4 3 25 2 5 4 26 2 6 5 7 2 7 6 7 1 8 6 26 am 9 6 27 1 10 8 9 1 11 8 10 1 12 8 14 1 13 8 29 1 14 9 12 1 15 9 13 1 16 9 19 1 17 10 11 1 18 10 18 1 19 10 30 1 20 11 15 1 21 11 16 1 22 11 31 1 23 12 15 1 24 12 32 1 25 12 33 1 26 13 17 1 27 13 34 1 28 14 17 1 29 14 35 1 30 14 36 1 31 15 37 1 32 15 38 1 33 16 21 1 34 16 22 1 35 16 39 1 36 17 40 1 37 17 41 1 38 18 20 1 39 18 42 1 40 18 43 1 41 19 44 1 42 19 45 1 43 19 46 1 44 20 21 1 45 20 47 1 46 20 48 1 47 21 24 2 48 22 23 1 49 22 49 1 50 22 50 1 51 23 25 1 52 23 51 1 53 23 52 1 54 24 25 1 55 24 53 1 56 27 28 1 57 27 54 1 58 27 55 1 59 28 56 1 60 28 57 1