@MOLECULE 2-phenyl-isoindole-1,3-dione 26 28 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.0420 2.2844 -0.2711 O.2 1 UNL1111 -0.4118 2 O 0.0408 -2.2826 0.2724 O.2 1 UNL1111 -0.4120 3 N -0.3405 0.0008 0.0008 N.am 1 UNL1111 -0.5639 4 C 1.8842 0.7015 -0.0785 C.ar 1 UNL1111 -0.1229 5 C 1.8838 -0.7013 0.0785 C.ar 1 UNL1111 -0.1229 6 C 0.4692 1.1745 -0.1360 C.2 1 UNL1111 0.5872 7 C 0.4684 -1.1731 0.1365 C.2 1 UNL1111 0.5871 8 C -1.7600 0.0005 -0.0000 C.ar 1 UNL1111 0.2092 9 C 3.0575 1.4133 -0.1546 C.ar 1 UNL1111 -0.0803 10 C 3.0566 -1.4141 0.1543 C.ar 1 UNL1111 -0.0803 11 C -2.4568 1.1096 0.4979 C.ar 1 UNL1111 -0.1954 12 C -2.4556 -1.1101 -0.4982 C.ar 1 UNL1111 -0.1952 13 C 4.2630 0.6893 -0.0746 C.ar 1 UNL1111 -0.1316 14 C 4.2625 -0.6913 0.0738 C.ar 1 UNL1111 -0.1317 15 C -3.8482 1.1020 0.4886 C.ar 1 UNL1111 -0.1186 16 C -3.8470 -1.1029 -0.4893 C.ar 1 UNL1111 -0.1187 17 C -4.5460 -0.0007 -0.0006 C.ar 1 UNL1111 -0.1747 18 H 3.0599 2.4971 -0.2726 H 1 UNL1111 0.1743 19 H 3.0576 -2.4980 0.2721 H 1 UNL1111 0.1743 20 H -1.9215 1.9767 0.8846 H 1 UNL1111 0.1784 21 H -1.9200 -1.9761 -0.8849 H 1 UNL1111 0.1783 22 H 5.2086 1.2297 -0.1323 H 1 UNL1111 0.1579 23 H 5.2070 -1.2327 0.1311 H 1 UNL1111 0.1578 24 H -4.3926 1.9653 0.8690 H 1 UNL1111 0.1518 25 H -4.3906 -1.9666 -0.8699 H 1 UNL1111 0.1518 26 H -5.6333 -0.0011 -0.0004 H 1 UNL1111 0.1517 @BOND 1 1 6 2 2 2 7 2 3 3 6 am 4 3 7 am 5 3 8 1 6 4 5 ar 7 4 6 1 8 4 9 ar 9 5 7 1 10 5 10 ar 11 8 11 ar 12 8 12 ar 13 9 13 ar 14 9 18 1 15 10 14 ar 16 10 19 1 17 11 15 ar 18 11 20 1 19 12 16 ar 20 12 21 1 21 13 14 ar 22 13 22 1 23 14 23 1 24 15 17 ar 25 15 24 1 26 16 17 ar 27 16 25 1 28 17 26 1