@MOLECULE n-(4'-fluorobiphenyl-4-ylcarbonyl)-3-nitro-4-(2-phenylsulfanylethylamino)benzenesulfonamide 60 63 0 0 0 SMALL GASTEIGER @ATOM 1 C -8.0268 4.0727 0.4850 C.ar 1 UNL1111 -0.2157 2 C -9.2483 3.4195 0.6437 C.ar 1 UNL1111 0.2031 3 C -9.3875 2.0348 0.5545 C.ar 1 UNL1111 -0.2153 4 C -8.2467 1.2796 0.2998 C.ar 1 UNL1111 -0.1075 5 C -7.0088 1.9079 0.1356 C.ar 1 UNL1111 -0.0625 6 C -6.8998 3.2981 0.2248 C.ar 1 UNL1111 -0.1061 7 F -10.3266 4.1479 0.8904 F 1 UNL1111 -0.1709 8 C -5.8165 1.0924 -0.1307 C.ar 1 UNL1111 0.0266 9 C -5.2263 1.1097 -1.3967 C.ar 1 UNL1111 -0.1745 10 C -4.1132 0.3138 -1.6518 C.ar 1 UNL1111 -0.0868 11 C -3.5960 -0.4954 -0.6402 C.ar 1 UNL1111 -0.1467 12 C -4.1668 -0.4967 0.6324 C.ar 1 UNL1111 -0.1139 13 C -5.2820 0.2956 0.8858 C.ar 1 UNL1111 -0.1735 14 C -2.4005 -1.3232 -0.9482 C.2 1 UNL1111 0.6219 15 O -1.4387 -0.8892 -1.5501 O.2 1 UNL1111 -0.5401 16 N -2.4156 -2.6369 -0.5023 N.am 1 UNL1111 -0.8876 17 S -1.1145 -3.8037 -0.7936 S.O2 1 UNL1111 2.4062 18 C 0.3386 -2.9357 -0.4297 C.ar 1 UNL1111 -0.5396 19 C 0.9312 -3.0271 0.8135 C.ar 1 UNL1111 0.1046 20 C 2.0946 -2.2953 1.1129 C.ar 1 UNL1111 -0.3145 21 C 2.6804 -1.4415 0.1205 C.ar 1 UNL1111 0.3636 22 C 2.0538 -1.3895 -1.1615 C.ar 1 UNL1111 -0.3656 23 C 0.9166 -2.1114 -1.4235 C.ar 1 UNL1111 0.1161 24 O -1.1572 -4.1526 -2.1866 O.2 1 UNL1111 -0.8774 25 O -1.3802 -4.7851 0.2315 O.2 1 UNL1111 -0.9022 26 N 2.6394 -2.4342 2.4273 N.pl3 1 UNL1111 0.6705 27 O 2.0832 -3.1716 3.2236 O.2 1 UNL1111 -0.3864 28 O 3.6561 -1.8046 2.7305 O.2 1 UNL1111 -0.4952 29 N 3.7885 -0.7177 0.3908 N.pl3 1 UNL1111 -0.4789 30 C 4.3904 0.2107 -0.5804 C.3 1 UNL1111 -0.0622 31 C 5.5798 0.9079 0.0838 C.3 1 UNL1111 -0.3582 32 S 6.2553 2.1262 -1.1149 S.3 1 UNL1111 0.0398 33 C 7.8151 2.6056 -0.4286 C.ar 1 UNL1111 -0.0780 34 C 8.6911 3.2586 -1.2985 C.ar 1 UNL1111 -0.1554 35 C 9.9243 3.7025 -0.8275 C.ar 1 UNL1111 -0.1306 36 C 10.2864 3.4904 0.5024 C.ar 1 UNL1111 -0.1515 37 C 9.4091 2.8354 1.3632 C.ar 1 UNL1111 -0.1275 38 C 8.1692 2.3940 0.9015 C.ar 1 UNL1111 -0.1714 39 H -7.9523 5.1562 0.5616 H 1 UNL1111 0.1765 40 H -10.3568 1.5553 0.6800 H 1 UNL1111 0.1767 41 H -8.3176 0.1940 0.2239 H 1 UNL1111 0.1627 42 H -5.9282 3.7759 0.0947 H 1 UNL1111 0.1637 43 H -5.6411 1.7414 -2.1819 H 1 UNL1111 0.1683 44 H -3.6399 0.3236 -2.6366 H 1 UNL1111 0.1707 45 H -3.7397 -1.1038 1.4316 H 1 UNL1111 0.1618 46 H -5.7383 0.3014 1.8753 H 1 UNL1111 0.1665 47 H -3.2497 -2.9863 -0.0343 H 1 UNL1111 0.3301 48 H 0.5060 -3.6789 1.6023 H 1 UNL1111 0.2011 49 H 2.4763 -0.7595 -1.9391 H 1 UNL1111 0.1713 50 H 0.4527 -2.0437 -2.4214 H 1 UNL1111 0.1835 51 H 4.2209 -0.7829 1.3194 H 1 UNL1111 0.3540 52 H 4.7128 -0.3607 -1.4868 H 1 UNL1111 0.1607 53 H 3.6192 0.9512 -0.9089 H 1 UNL1111 0.1614 54 H 5.2681 1.4280 1.0108 H 1 UNL1111 0.1729 55 H 6.3604 0.1747 0.3667 H 1 UNL1111 0.1733 56 H 8.4305 3.4288 -2.3443 H 1 UNL1111 0.1631 57 H 10.6087 4.2151 -1.5025 H 1 UNL1111 0.1553 58 H 11.2525 3.8364 0.8662 H 1 UNL1111 0.1565 59 H 9.6887 2.6683 2.4031 H 1 UNL1111 0.1569 60 H 7.4993 1.8963 1.6010 H 1 UNL1111 0.1564 @BOND 1 1 2 ar 2 1 6 ar 3 1 39 1 4 2 3 ar 5 2 7 1 6 3 4 ar 7 3 40 1 8 4 5 ar 9 4 41 1 10 5 6 ar 11 5 8 1 12 6 42 1 13 8 9 ar 14 8 13 ar 15 9 10 ar 16 9 43 1 17 10 11 ar 18 10 44 1 19 11 12 ar 20 11 14 1 21 12 13 ar 22 12 45 1 23 13 46 1 24 14 15 2 25 14 16 am 26 16 17 1 27 16 47 1 28 17 18 1 29 17 24 2 30 17 25 2 31 18 19 ar 32 18 23 ar 33 19 20 ar 34 19 48 1 35 20 21 ar 36 20 26 1 37 21 22 ar 38 21 29 1 39 22 23 ar 40 22 49 1 41 23 50 1 42 26 27 2 43 26 28 2 44 29 30 1 45 29 51 1 46 30 31 1 47 30 52 1 48 30 53 1 49 31 32 1 50 31 54 1 51 31 55 1 52 32 33 1 53 33 34 ar 54 33 38 ar 55 34 35 ar 56 34 56 1 57 35 36 ar 58 35 57 1 59 36 37 ar 60 36 58 1 61 37 38 ar 62 37 59 1 63 38 60 1