@MOLECULE (3s,4r)-4,8-dihydroxy-3-methyl-3,4-dihydro-1,7,12(2h)-tetraphenetrione 38 41 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.0398 -0.4292 -1.8781 O.3 1 UNL1111111111 -0.5329 2 O -1.6874 2.3274 -0.8670 O.2 1 UNL1111111111 -0.4171 3 O 0.2364 2.0980 1.0930 O.2 1 UNL1111111111 -0.3740 4 O 2.3373 -2.5142 0.7549 O.2 1 UNL1111111111 -0.3852 5 O 4.5758 -1.5923 -0.3133 O.3 1 UNL1111111111 -0.4165 6 C -4.3343 0.2291 0.4417 C.3 1 UNL1111111111 -0.1231 7 C -3.7836 -0.8250 -0.5514 C.3 1 UNL1111111111 0.1201 8 C -3.5556 1.5527 0.3710 C.3 1 UNL1111111111 -0.3964 9 C -2.3056 -1.0295 -0.3390 C.ar 1 UNL1111111111 -0.0234 10 C -1.5159 0.1047 -0.1146 C.ar 1 UNL1111111111 -0.1110 11 C -2.1834 1.4279 -0.2374 C.2 1 UNL1111111111 0.4688 12 C -0.1621 -0.0339 0.1618 C.ar 1 UNL1111111111 -0.0684 13 C -4.3058 -0.3511 1.8565 C.3 1 UNL1111111111 -0.4562 14 C 0.4183 -1.3058 0.1410 C.ar 1 UNL1111111111 -0.1263 15 C -1.7306 -2.2953 -0.3418 C.ar 1 UNL1111111111 -0.1502 16 C -0.3603 -2.4327 -0.1097 C.ar 1 UNL1111111111 -0.0735 17 C 0.6822 1.1361 0.5212 C.2 1 UNL1111111111 0.4392 18 C 1.8833 -1.4650 0.3738 C.2 1 UNL1111111111 0.4669 19 C 2.1251 1.0115 0.1810 C.ar 1 UNL1111111111 -0.0330 20 C 2.6999 -0.2646 0.1077 C.ar 1 UNL1111111111 -0.2345 21 C 4.0575 -0.3501 -0.2202 C.ar 1 UNL1111111111 0.3300 22 C 2.8728 2.1568 -0.0480 C.ar 1 UNL1111111111 -0.1735 23 C 4.8309 0.7983 -0.4624 C.ar 1 UNL1111111111 -0.3025 24 C 4.2312 2.0445 -0.3718 C.ar 1 UNL1111111111 -0.0481 25 H -5.3972 0.4306 0.1525 H 1 UNL1111111111 0.1574 26 H -4.3620 -1.7767 -0.4814 H 1 UNL1111111111 0.1548 27 H -3.4444 1.9980 1.3851 H 1 UNL1111111111 0.1884 28 H -4.1374 2.3111 -0.1964 H 1 UNL1111111111 0.1778 29 H -3.2796 -0.5478 2.1934 H 1 UNL1111111111 0.1575 30 H -4.7605 0.3360 2.5802 H 1 UNL1111111111 0.1525 31 H -4.8592 -1.2950 1.9203 H 1 UNL1111111111 0.1480 32 H -2.3422 -3.1777 -0.5287 H 1 UNL1111111111 0.1639 33 H 0.1072 -3.4221 -0.1164 H 1 UNL1111111111 0.1782 34 H -3.5489 0.3888 -2.1104 H 1 UNL1111111111 0.3208 35 H 2.4019 3.1392 0.0269 H 1 UNL1111111111 0.1818 36 H 5.8825 0.7058 -0.7151 H 1 UNL1111111111 0.1628 37 H 4.8169 2.9471 -0.5529 H 1 UNL1111111111 0.1549 38 H 5.5418 -1.5811 -0.5390 H 1 UNL1111111111 0.3224 @BOND 1 1 7 1 2 1 34 1 3 2 11 2 4 3 17 2 5 4 18 2 6 5 21 1 7 5 38 1 8 6 7 1 9 6 8 1 10 6 13 1 11 6 25 1 12 7 9 1 13 7 26 1 14 8 11 1 15 8 27 1 16 8 28 1 17 9 10 ar 18 9 15 ar 19 10 11 1 20 10 12 ar 21 12 14 ar 22 12 17 1 23 13 29 1 24 13 30 1 25 13 31 1 26 14 16 ar 27 14 18 1 28 15 16 ar 29 15 32 1 30 16 33 1 31 17 19 1 32 18 20 1 33 19 20 ar 34 19 22 ar 35 20 21 ar 36 21 23 ar 37 22 24 ar 38 22 35 1 39 23 24 ar 40 23 36 1 41 24 37 1