@MOLECULE 6-hydroxy-3,3,12-trimethyl-10-nitro-3,12-dihydro-7h-pyrano[2,3-c]acridin-7-one 42 45 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -4.3370 -0.0091 0.1996 O.3 1 UNL1 -0.3384 2 O -1.5805 3.6781 -0.0417 O.3 1 UNL1 -0.4504 3 O 0.9825 3.3307 -0.1440 O.2 1 UNL1 -0.5396 4 O 6.3452 -0.9635 0.3800 O.2 1 UNL1 -0.3767 5 O 5.0508 -2.6163 -0.0934 O.2 1 UNL1 -0.3978 6 N 0.4325 -0.7010 -0.2544 N.ar 1 UNL1 -0.3566 7 N 5.2503 -1.4315 0.1217 N.pl3 1 UNL1 0.6069 8 C -0.6827 0.1152 -0.0538 C.ar 1 UNL1 0.3826 9 C -4.6084 -1.4325 0.0633 C.3 1 UNL1 0.3216 10 C -1.9601 -0.4354 0.1632 C.ar 1 UNL1 -0.3706 11 C -0.5122 1.5222 -0.0575 C.ar 1 UNL1 -0.4852 12 C -3.0795 0.4325 0.1233 C.ar 1 UNL1 0.4243 13 C 1.7273 -0.1915 -0.1358 C.ar 1 UNL1 0.2397 14 C -3.4839 -2.2694 0.5766 C.2 1 UNL1 -0.2889 15 C -2.2315 -1.7911 0.5890 C.2 1 UNL1 -0.0599 16 C 1.9447 1.1964 -0.0307 C.ar 1 UNL1 -0.2125 17 C 0.8010 2.1191 -0.0908 C.ar 1 UNL1 0.5334 18 C -1.6684 2.3511 -0.0113 C.ar 1 UNL1 0.4835 19 C -2.9550 1.8209 0.0451 C.ar 1 UNL1 -0.4545 20 C -4.8406 -1.6709 -1.4290 C.3 1 UNL1 -0.4922 21 C -5.8818 -1.5891 0.8921 C.3 1 UNL1 -0.4794 22 C 0.2751 -2.0153 -0.8943 C.3 1 UNL1 -0.2340 23 C 2.8364 -1.0626 -0.0852 C.ar 1 UNL1 -0.2289 24 C 3.2360 1.7081 0.1201 C.ar 1 UNL1 -0.0240 25 C 4.1046 -0.5210 0.0647 C.ar 1 UNL1 0.0255 26 C 4.3300 0.8556 0.1691 C.ar 1 UNL1 -0.1901 27 H -3.7466 -3.2582 0.9317 H 1 UNL1 0.1629 28 H -1.4024 -2.3723 0.9925 H 1 UNL1 0.1537 29 H -3.8282 2.4669 0.0385 H 1 UNL1 0.2087 30 H -3.9207 -1.5047 -2.0037 H 1 UNL1 0.1616 31 H -5.1745 -2.6955 -1.6213 H 1 UNL1 0.1576 32 H -5.6004 -0.9858 -1.8264 H 1 UNL1 0.1658 33 H -6.3047 -2.5932 0.7866 H 1 UNL1 0.1577 34 H -5.6852 -1.4113 1.9579 H 1 UNL1 0.1665 35 H -6.6482 -0.8654 0.5828 H 1 UNL1 0.1674 36 H 1.0123 -2.1466 -1.7095 H 1 UNL1 0.1602 37 H -0.7259 -2.1168 -1.3575 H 1 UNL1 0.1733 38 H 0.4084 -2.8307 -0.1604 H 1 UNL1 0.1576 39 H 2.7077 -2.1462 -0.1406 H 1 UNL1 0.1969 40 H 3.3696 2.7955 0.1954 H 1 UNL1 0.1906 41 H 5.3440 1.2460 0.2890 H 1 UNL1 0.1951 42 H -0.6014 3.9871 -0.0966 H 1 UNL1 0.3862 @BOND 1 30 20 1 2 32 20 1 3 36 22 1 4 31 20 1 5 20 9 1 6 37 22 1 7 22 6 1 8 22 38 1 9 6 13 ar 10 6 8 ar 11 3 17 2 12 39 23 1 13 13 23 ar 14 13 16 ar 15 42 2 1 16 5 7 2 17 17 11 ar 18 17 16 ar 19 23 25 ar 20 11 8 ar 21 11 18 ar 22 8 10 ar 23 2 18 1 24 16 24 ar 25 18 19 ar 26 29 19 1 27 19 12 ar 28 9 1 1 29 9 14 1 30 9 21 1 31 25 7 1 32 25 26 ar 33 24 26 ar 34 24 40 1 35 7 4 2 36 12 10 ar 37 12 1 1 38 10 15 1 39 26 41 1 40 14 15 2 41 14 27 1 42 35 21 1 43 15 28 1 44 33 21 1 45 21 34 1