@MOLECULE 3,3-bisc4-dimethylaminophenyl7-6-dimethylaminophthalide 60 63 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.2501 -0.0930 -2.0106 O.3 1 UNL1111111111 -0.4045 2 O 1.9644 -0.4145 -3.4056 O.2 1 UNL1111111111 -0.4352 3 N 5.4918 -0.3707 0.8754 N.pl3 1 UNL1111111111 -0.3813 4 N -2.1931 5.0914 0.7002 N.pl3 1 UNL1111111111 -0.3887 5 N -3.5713 -4.4089 0.2815 N.pl3 1 UNL1111111111 -0.3876 6 C 0.0035 -0.0309 -0.5672 C.3 1 UNL1111111111 0.2905 7 C 1.3834 -0.1352 0.0420 C.ar 1 UNL1111111111 -0.1080 8 C -0.6186 1.3050 -0.2748 C.ar 1 UNL1111111111 -0.1349 9 C -0.9214 -1.1799 -0.2886 C.ar 1 UNL1111111111 -0.1428 10 C 2.3199 -0.3154 -0.9863 C.ar 1 UNL1111111111 -0.1068 11 C 1.5870 -0.3019 -2.2754 C.2 1 UNL1111111111 0.5928 12 C 1.8052 -0.0439 1.3527 C.ar 1 UNL1111111111 -0.0827 13 C 3.6665 -0.4440 -0.7439 C.ar 1 UNL1111111111 -0.1910 14 C -1.3668 1.4784 0.8903 C.ar 1 UNL1111111111 -0.0716 15 C -2.0747 -1.2948 -1.0704 C.ar 1 UNL1111111111 -0.0352 16 C -0.4399 2.3826 -1.1405 C.ar 1 UNL1111111111 -0.0522 17 C -0.6702 -2.1297 0.6978 C.ar 1 UNL1111111111 -0.0679 18 C 4.1134 -0.3740 0.6016 C.ar 1 UNL1111111111 0.2098 19 C 3.1680 -0.1735 1.6281 C.ar 1 UNL1111111111 -0.2520 20 C -1.9275 2.7104 1.1947 C.ar 1 UNL1111111111 -0.2831 21 C -2.9743 -2.3283 -0.8592 C.ar 1 UNL1111111111 -0.2891 22 C -0.9973 3.6209 -0.8503 C.ar 1 UNL1111111111 -0.2832 23 C -1.5661 -3.1662 0.9276 C.ar 1 UNL1111111111 -0.2928 24 C -1.7445 3.8099 0.3299 C.ar 1 UNL1111111111 0.2325 25 C -2.7332 -3.2887 0.1464 C.ar 1 UNL1111111111 0.2408 26 C 5.8979 -0.6174 2.2686 C.3 1 UNL1111111111 -0.2593 27 C 6.3561 -1.0647 -0.0957 C.3 1 UNL1111111111 -0.2569 28 C -3.3161 5.1471 1.6529 C.3 1 UNL1111111111 -0.2572 29 C -2.3292 6.0829 -0.3811 C.3 1 UNL1111111111 -0.2569 30 C -4.9430 -4.2797 -0.2389 C.3 1 UNL1111111111 -0.2557 31 C -3.5216 -5.1258 1.5668 C.3 1 UNL1111111111 -0.2567 32 H 1.0959 0.1321 2.1606 H 1 UNL1111111111 0.1611 33 H 4.3593 -0.5798 -1.5705 H 1 UNL1111111111 0.1738 34 H -1.5208 0.6357 1.5668 H 1 UNL1111111111 0.1543 35 H -2.2639 -0.5597 -1.8582 H 1 UNL1111111111 0.1674 36 H 0.1367 2.2543 -2.0603 H 1 UNL1111111111 0.1674 37 H 0.2369 -2.0716 1.3013 H 1 UNL1111111111 0.1539 38 H 3.4892 -0.1050 2.6636 H 1 UNL1111111111 0.1564 39 H -2.5004 2.8152 2.1094 H 1 UNL1111111111 0.1537 40 H -3.8569 -2.3921 -1.4873 H 1 UNL1111111111 0.1575 41 H -0.8386 4.4400 -1.5443 H 1 UNL1111111111 0.1573 42 H -1.3419 -3.8877 1.7053 H 1 UNL1111111111 0.1535 43 H 6.9979 -0.5996 2.3508 H 1 UNL1111111111 0.1491 44 H 5.5352 -1.5776 2.6689 H 1 UNL1111111111 0.1322 45 H 5.5251 0.2037 2.9084 H 1 UNL1111111111 0.1542 46 H 6.0489 -2.1055 -0.2889 H 1 UNL1111111111 0.1366 47 H 7.4008 -1.0717 0.2558 H 1 UNL1111111111 0.1465 48 H 6.3512 -0.5054 -1.0502 H 1 UNL1111111111 0.1592 49 H -2.9832 4.7495 2.6290 H 1 UNL1111111111 0.1524 50 H -4.2007 4.5808 1.3200 H 1 UNL1111111111 0.1328 51 H -3.6172 6.1932 1.8271 H 1 UNL1111111111 0.1463 52 H -1.3297 6.2982 -0.8026 H 1 UNL1111111111 0.1558 53 H -2.7098 7.0355 0.0228 H 1 UNL1111111111 0.1456 54 H -2.9977 5.7563 -1.1938 H 1 UNL1111111111 0.1332 55 H -5.5132 -5.2028 -0.0447 H 1 UNL1111111111 0.1456 56 H -4.9036 -4.1607 -1.3379 H 1 UNL1111111111 0.1571 57 H -5.4966 -3.4306 0.1929 H 1 UNL1111111111 0.1320 58 H -2.5217 -5.5820 1.6890 H 1 UNL1111111111 0.1545 59 H -4.2464 -5.9566 1.5685 H 1 UNL1111111111 0.1468 60 H -3.7287 -4.4811 2.4357 H 1 UNL1111111111 0.1305 @BOND 1 1 6 1 2 1 11 1 3 2 11 2 4 3 18 1 5 3 26 1 6 3 27 1 7 4 24 1 8 4 28 1 9 4 29 1 10 5 25 1 11 5 30 1 12 5 31 1 13 6 7 1 14 6 8 1 15 6 9 1 16 7 10 ar 17 7 12 ar 18 8 14 ar 19 8 16 ar 20 9 15 ar 21 9 17 ar 22 10 11 1 23 10 13 ar 24 12 19 ar 25 12 32 1 26 13 18 ar 27 13 33 1 28 14 20 ar 29 14 34 1 30 15 21 ar 31 15 35 1 32 16 22 ar 33 16 36 1 34 17 23 ar 35 17 37 1 36 18 19 ar 37 19 38 1 38 20 24 ar 39 20 39 1 40 21 25 ar 41 21 40 1 42 22 24 ar 43 22 41 1 44 23 25 ar 45 23 42 1 46 26 43 1 47 26 44 1 48 26 45 1 49 27 46 1 50 27 47 1 51 27 48 1 52 28 49 1 53 28 50 1 54 28 51 1 55 29 52 1 56 29 53 1 57 29 54 1 58 30 55 1 59 30 56 1 60 30 57 1 61 31 58 1 62 31 59 1 63 31 60 1