@MOLECULE n-({6-[(4-cyano-2-fluorobenzyl)oxy]-2-naphthyl}sulfonyl)-d-glutamic acid 53 55 0 0 0 SMALL GASTEIGER @ATOM 1 N -8.5782 3.1384 -0.3179 N.1 1 UNL1111111111 -0.2091 2 C -7.9300 2.1832 -0.2407 C.1 1 UNL1111111111 0.0991 3 C -7.1322 1.0090 -0.1462 C.ar 1 UNL1111111111 0.0060 4 C -6.2750 0.8380 0.9457 C.ar 1 UNL1111111111 -0.1350 5 C -5.4894 -0.3079 1.0404 C.ar 1 UNL1111111111 -0.1090 6 C -7.2166 0.0363 -1.1468 C.ar 1 UNL1111111111 -0.1778 7 C -6.4143 -1.0941 -1.0236 C.ar 1 UNL1111111111 0.1669 8 C -5.5378 -1.2885 0.0484 C.ar 1 UNL1111111111 -0.0928 9 C -4.6804 -2.5101 0.1459 C.3 1 UNL1111111111 -0.0439 10 O -3.5605 -2.3027 0.9966 O.3 1 UNL1111111111 -0.3192 11 C -2.5826 -1.4501 0.5850 C.ar 1 UNL1111111111 0.2695 12 C -2.5378 -0.8311 -0.6904 C.ar 1 UNL1111111111 -0.2811 13 C -1.4966 0.0109 -0.9793 C.ar 1 UNL1111111111 -0.0672 14 C -1.6092 -1.2330 1.5401 C.ar 1 UNL1111111111 -0.3148 15 C -0.5366 -0.3608 1.2454 C.ar 1 UNL1111111111 0.1000 16 C -0.4758 0.2654 -0.0229 C.ar 1 UNL1111111111 -0.1174 17 C 0.6033 1.1398 -0.3173 C.ar 1 UNL1111111111 -0.0251 18 C 0.4844 -0.0860 2.2001 C.ar 1 UNL1111111111 -0.2052 19 C 1.5098 0.7704 1.8966 C.ar 1 UNL1111111111 -0.0507 20 C 1.5745 1.3848 0.6207 C.ar 1 UNL1111111111 -0.4079 21 S 2.9052 2.4567 0.2257 S.O2 1 UNL1111111111 2.3469 22 O 2.8883 2.6398 -1.2070 O.2 1 UNL1111111111 -0.9225 23 O 2.9722 3.5617 1.1447 O.2 1 UNL1111111111 -0.8719 24 N 4.3069 1.4813 0.6017 N.3 1 UNL1111111111 -0.8654 25 C 4.7929 0.5280 -0.3922 C.3 1 UNL1111111111 0.0436 26 C 6.0349 1.0793 -1.0893 C.2 1 UNL1111111111 0.5974 27 O 6.2520 0.4216 -2.2541 O.3 1 UNL1111111111 -0.5683 28 O 6.7694 1.9492 -0.7094 O.2 1 UNL1111111111 -0.4960 29 C 5.1721 -0.7796 0.3385 C.3 1 UNL1111111111 -0.2723 30 C 5.2552 -1.9518 -0.6348 C.3 1 UNL1111111111 -0.3551 31 C 5.5485 -3.2107 0.1128 C.2 1 UNL1111111111 0.6451 32 O 5.5872 -4.2650 -0.7449 O.3 1 UNL1111111111 -0.5659 33 O 5.7314 -3.3717 1.2903 O.2 1 UNL1111111111 -0.5087 34 F -6.4875 -2.0212 -1.9655 F 1 UNL1111111111 -0.1568 35 H -6.2209 1.6025 1.7233 H 1 UNL1111111111 0.1759 36 H -7.8907 0.1640 -1.9958 H 1 UNL1111111111 0.1886 37 H -4.8219 -0.4402 1.8982 H 1 UNL1111111111 0.1828 38 H -5.2042 -3.3311 0.6896 H 1 UNL1111111111 0.1740 39 H -4.3376 -2.8998 -0.8315 H 1 UNL1111111111 0.1532 40 H -3.3205 -1.0189 -1.4217 H 1 UNL1111111111 0.1779 41 H -1.6663 -1.7240 2.5085 H 1 UNL1111111111 0.1821 42 H -1.4388 0.5041 -1.9524 H 1 UNL1111111111 0.1616 43 H 0.4290 -0.5697 3.1737 H 1 UNL1111111111 0.1614 44 H 0.6328 1.6027 -1.3138 H 1 UNL1111111111 0.1784 45 H 2.2843 0.9773 2.6427 H 1 UNL1111111111 0.1681 46 H 5.0594 1.9526 1.1100 H 1 UNL1111111111 0.3245 47 H 4.0075 0.3148 -1.1734 H 1 UNL1111111111 0.1850 48 H 6.1222 -0.6614 0.8979 H 1 UNL1111111111 0.1656 49 H 4.4144 -0.9876 1.1280 H 1 UNL1111111111 0.1810 50 H 7.0279 0.7593 -2.7672 H 1 UNL1111111111 0.3608 51 H 4.3112 -2.0684 -1.2136 H 1 UNL1111111111 0.1867 52 H 6.0356 -1.7790 -1.4140 H 1 UNL1111111111 0.2001 53 H 5.7830 -5.1283 -0.3052 H 1 UNL1111111111 0.3569 @BOND 1 1 2 3 2 2 3 1 3 3 4 ar 4 3 6 ar 5 4 5 ar 6 4 35 1 7 5 8 ar 8 5 37 1 9 6 7 ar 10 6 36 1 11 7 8 ar 12 7 34 1 13 8 9 1 14 9 10 1 15 9 38 1 16 9 39 1 17 10 11 1 18 11 12 ar 19 11 14 ar 20 12 13 ar 21 12 40 1 22 13 16 ar 23 13 42 1 24 14 15 ar 25 14 41 1 26 15 16 ar 27 15 18 ar 28 16 17 ar 29 17 20 ar 30 17 44 1 31 18 19 ar 32 18 43 1 33 19 20 ar 34 19 45 1 35 20 21 1 36 21 22 2 37 21 23 2 38 21 24 1 39 24 25 1 40 24 46 1 41 25 26 1 42 25 29 1 43 25 47 1 44 26 27 1 45 26 28 2 46 27 50 1 47 29 30 1 48 29 48 1 49 29 49 1 50 30 31 1 51 30 51 1 52 30 52 1 53 31 32 1 54 31 33 2 55 32 53 1