@MOLECULE 4-{[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)carbonyl]amino}benzoic acid 51 53 0 0 0 SMALL USER_CHARGES @ATOM 1 O 0.8844 -1.3224 1.3064 O.2 1 UNL11111111 -0.4719 2 O 7.6911 0.8586 -0.9763 O.3 1 UNL11111111 -0.5684 3 O 7.7843 -0.8990 0.3821 O.2 1 UNL11111111 -0.5140 4 N 1.4768 0.4695 0.0092 N.am 1 UNL11111111 -0.5762 5 C -4.0873 -1.6054 -0.5356 C.3 1 UNL11111111 0.0963 6 C -4.9748 1.2510 0.0221 C.3 1 UNL11111111 0.0867 7 C -5.5571 -1.1849 -0.3358 C.3 1 UNL11111111 -0.2926 8 C -5.7918 0.2446 -0.8123 C.3 1 UNL11111111 -0.2928 9 C -3.1355 -0.5232 -0.0731 C.ar 1 UNL11111111 -0.0368 10 C -3.5431 0.7896 0.1928 C.ar 1 UNL11111111 0.0107 11 C -3.8144 -1.8821 -2.0248 C.3 1 UNL11111111 -0.4567 12 C -3.8620 -2.8955 0.2766 C.3 1 UNL11111111 -0.4615 13 C -5.0187 2.6028 -0.7167 C.3 1 UNL11111111 -0.4634 14 C -5.5960 1.4097 1.4208 C.3 1 UNL11111111 -0.4561 15 C -1.7862 -0.8620 0.0772 C.ar 1 UNL11111111 -0.1089 16 C -2.6043 1.7192 0.6625 C.ar 1 UNL11111111 -0.1780 17 C -0.8624 0.0812 0.5121 C.ar 1 UNL11111111 -0.1560 18 C -1.2691 1.3769 0.8258 C.ar 1 UNL11111111 -0.1287 19 C 0.5502 -0.3489 0.6764 C.2 1 UNL11111111 0.5948 20 C 2.8694 0.2897 -0.0100 C.ar 1 UNL11111111 0.2896 21 C 3.5282 -0.7078 0.7263 C.ar 1 UNL11111111 -0.2634 22 C 3.6142 1.1810 -0.8136 C.ar 1 UNL11111111 -0.3078 23 C 4.9104 -0.8118 0.6549 C.ar 1 UNL11111111 -0.0174 24 C 4.9942 1.0670 -0.8748 C.ar 1 UNL11111111 -0.0061 25 C 5.6472 0.0716 -0.1420 C.ar 1 UNL11111111 -0.2209 26 C 7.1011 -0.0804 -0.1816 C.2 1 UNL11111111 0.6561 27 H -5.8322 -1.2764 0.7330 H 1 UNL11111111 0.1461 28 H -6.2242 -1.8825 -0.8755 H 1 UNL11111111 0.1421 29 H -5.5194 0.3352 -1.8817 H 1 UNL11111111 0.1446 30 H -6.8675 0.4950 -0.7560 H 1 UNL11111111 0.1421 31 H -2.7869 -2.2254 -2.1882 H 1 UNL11111111 0.1502 32 H -4.4864 -2.6534 -2.4148 H 1 UNL11111111 0.1486 33 H -3.9558 -0.9798 -2.6296 H 1 UNL11111111 0.1472 34 H -4.6450 -3.6331 0.0712 H 1 UNL11111111 0.1485 35 H -2.9044 -3.3713 0.0392 H 1 UNL11111111 0.1523 36 H -3.8682 -2.6912 1.3536 H 1 UNL11111111 0.1528 37 H -6.0470 2.8727 -0.9818 H 1 UNL11111111 0.1505 38 H -4.6221 3.4195 -0.1054 H 1 UNL11111111 0.1476 39 H -4.4332 2.5674 -1.6420 H 1 UNL11111111 0.1494 40 H -6.6435 1.7218 1.3566 H 1 UNL11111111 0.1495 41 H -5.5616 0.4678 1.9805 H 1 UNL11111111 0.1522 42 H -5.0619 2.1586 2.0155 H 1 UNL11111111 0.1485 43 H -1.4485 -1.8793 -0.1384 H 1 UNL11111111 0.1715 44 H -2.9257 2.7306 0.9107 H 1 UNL11111111 0.1586 45 H -0.5580 2.1079 1.2071 H 1 UNL11111111 0.1580 46 H 1.1119 1.2479 -0.5370 H 1 UNL11111111 0.3173 47 H 2.9689 -1.4048 1.3554 H 1 UNL11111111 0.2057 48 H 3.1115 1.9549 -1.3865 H 1 UNL11111111 0.1604 49 H 5.4324 -1.5882 1.2249 H 1 UNL11111111 0.1746 50 H 5.5744 1.7551 -1.4968 H 1 UNL11111111 0.1703 51 H 8.6744 0.7697 -1.0123 H 1 UNL11111111 0.3549 @BOND 1 33 11 1 2 32 11 1 3 31 11 1 4 11 5 1 5 29 8 1 6 39 13 1 7 50 24 1 8 48 22 1 9 51 2 1 10 37 13 1 11 2 26 1 12 28 7 1 13 24 22 ar 14 24 25 ar 15 22 20 ar 16 8 30 1 17 8 7 1 18 8 6 1 19 13 38 1 20 13 6 1 21 46 4 1 22 5 7 1 23 5 9 1 24 5 12 1 25 7 27 1 26 26 25 1 27 26 3 2 28 25 23 ar 29 43 15 1 30 9 15 ar 31 9 10 ar 32 20 4 1 33 20 21 ar 34 4 19 am 35 6 10 1 36 6 14 1 37 35 12 1 38 34 12 1 39 15 17 ar 40 10 16 ar 41 12 36 1 42 17 19 1 43 17 18 ar 44 23 21 ar 45 23 49 1 46 16 18 ar 47 16 44 1 48 19 1 2 49 21 47 1 50 18 45 1 51 40 14 1 52 14 41 1 53 14 42 1