@MOLECULE 1,3-dihydro-2h-isoindol-2-yl[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]methanone 43 45 0 0 0 SMALL GASTEIGER @ATOM 1 C 2.8917 1.7847 1.9837 C.3 1 UNL1111111111111 -0.4643 2 C 3.5287 1.2424 0.6895 C.3 1 UNL1111111111111 0.1435 3 C 4.9313 0.7162 1.0416 C.3 1 UNL1111111111111 -0.4640 4 C 2.7108 0.1294 0.0720 C.ar 1 UNL1111111111111 -0.1111 5 C 1.4877 -0.2741 0.5965 C.ar 1 UNL1111111111111 -0.0816 6 C 0.7397 -1.2910 -0.0046 C.ar 1 UNL1111111111111 -0.1966 7 C -0.5698 -1.7023 0.5595 C.2 1 UNL1111111111111 0.5809 8 O -0.8348 -2.8515 0.8481 O.2 1 UNL1111111111111 -0.5109 9 N -1.4913 -0.6907 0.8367 N.am 1 UNL1111111111111 -0.4941 10 C -2.8876 -1.0961 1.1622 C.3 1 UNL1111111111111 -0.0809 11 C -3.7518 -0.1320 0.4027 C.ar 1 UNL1111111111111 -0.0358 12 C -5.1272 -0.1049 0.2818 C.ar 1 UNL1111111111111 -0.1600 13 C -5.7044 0.9061 -0.4983 C.ar 1 UNL1111111111111 -0.1412 14 C -4.9125 1.8573 -1.1341 C.ar 1 UNL1111111111111 -0.1497 15 C -3.5170 1.8287 -1.0087 C.ar 1 UNL1111111111111 -0.1565 16 C -2.9515 0.8322 -0.2385 C.ar 1 UNL1111111111111 -0.0455 17 C -1.5006 0.5776 0.0585 C.3 1 UNL1111111111111 -0.0781 18 C 1.2167 -1.9660 -1.1241 C.ar 1 UNL1111111111111 -0.0352 19 C 2.4347 -1.5863 -1.6790 C.ar 1 UNL1111111111111 -0.3195 20 C 3.6274 2.4032 -0.3170 C.3 1 UNL1111111111111 -0.4640 21 C 3.1517 -0.5460 -1.0844 C.ar 1 UNL1111111111111 0.2947 22 O 4.3298 -0.1331 -1.6206 O.3 1 UNL1111111111111 -0.4729 23 H 3.5036 2.5873 2.4102 H 1 UNL1111111111111 0.1466 24 H 1.8968 2.2031 1.8028 H 1 UNL1111111111111 0.1452 25 H 2.8078 1.0038 2.7476 H 1 UNL1111111111111 0.1506 26 H 4.8715 -0.1806 1.6672 H 1 UNL1111111111111 0.1488 27 H 5.5057 0.4539 0.1454 H 1 UNL1111111111111 0.1608 28 H 5.5119 1.4684 1.5841 H 1 UNL1111111111111 0.1438 29 H 4.1986 3.2389 0.0986 H 1 UNL1111111111111 0.1438 30 H 4.1330 2.0944 -1.2398 H 1 UNL1111111111111 0.1591 31 H 2.6359 2.7753 -0.5927 H 1 UNL1111111111111 0.1442 32 H 1.0859 0.1976 1.4974 H 1 UNL1111111111111 0.1715 33 H 0.6415 -2.7865 -1.5581 H 1 UNL1111111111111 0.1676 34 H -3.0799 -2.1592 0.8897 H 1 UNL1111111111111 0.1742 35 H -3.0276 -1.0090 2.2636 H 1 UNL1111111111111 0.1636 36 H -1.0670 1.3830 0.6953 H 1 UNL1111111111111 0.1600 37 H -0.8843 0.5097 -0.8626 H 1 UNL1111111111111 0.1563 38 H -5.7519 -0.8451 0.7749 H 1 UNL1111111111111 0.1589 39 H -6.7873 0.9434 -0.6064 H 1 UNL1111111111111 0.1516 40 H -5.3784 2.6339 -1.7377 H 1 UNL1111111111111 0.1511 41 H -2.9038 2.5742 -1.5067 H 1 UNL1111111111111 0.1556 42 H 2.8204 -2.0943 -2.5567 H 1 UNL1111111111111 0.1640 43 H 4.5873 -0.6663 -2.4118 H 1 UNL1111111111111 0.3256 @BOND 1 1 2 1 2 1 23 1 3 1 24 1 4 1 25 1 5 2 3 1 6 2 4 1 7 2 20 1 8 3 26 1 9 3 27 1 10 3 28 1 11 4 5 ar 12 4 21 ar 13 5 6 ar 14 5 32 1 15 6 7 1 16 6 18 ar 17 7 8 2 18 7 9 am 19 9 10 1 20 9 17 1 21 10 11 1 22 10 34 1 23 10 35 1 24 11 12 ar 25 11 16 ar 26 12 13 ar 27 12 38 1 28 13 14 ar 29 13 39 1 30 14 15 ar 31 14 40 1 32 15 16 ar 33 15 41 1 34 16 17 1 35 17 36 1 36 17 37 1 37 18 19 ar 38 18 33 1 39 19 21 ar 40 19 42 1 41 20 29 1 42 20 30 1 43 20 31 1 44 21 22 1 45 22 43 1