@MOLECULE ethidium 44 47 0 0 0 SMALL GASTEIGER @ATOM 1 C -3.1973 -1.3936 0.0296 C.ar 1 UNL1111 -0.0284 2 C -4.3361 -0.6090 0.0653 C.ar 1 UNL1111 -0.3448 3 C -4.1972 0.7927 0.1258 C.ar 1 UNL1111 0.3158 4 C -2.9261 1.3782 0.1599 C.ar 1 UNL1111 -0.4208 5 N -0.5067 1.1443 0.2129 N.ar 1 UNL1111 -0.2870 6 C 0.6307 0.3618 0.1186 C.ar 1 UNL1111 -0.0368 7 C 1.7148 -1.8384 -0.0125 C.ar 1 UNL1111 -0.3025 8 C 1.6221 -3.2287 -0.0951 C.ar 1 UNL1111 0.2430 9 C 0.3556 -3.8574 -0.1135 C.ar 1 UNL1111 -0.2715 10 C -0.7905 -3.0804 -0.0613 C.ar 1 UNL1111 -0.0918 11 C 0.5452 -1.0549 0.0393 C.ar 1 UNL1111 0.0662 12 C -0.7266 -1.6824 0.0140 C.ar 1 UNL1111 -0.0615 13 C -1.9089 -0.8457 0.0609 C.ar 1 UNL1111 -0.1565 14 C -1.7772 0.5673 0.1317 C.ar 1 UNL1111 0.2825 15 C 1.9501 1.0065 0.1322 C.ar 1 UNL1111 0.0070 16 C 2.6206 1.2406 -1.0710 C.ar 1 UNL1111 -0.1472 17 C 3.8848 1.8247 -1.0555 C.ar 1 UNL1111 -0.1481 18 C 4.4799 2.1714 0.1566 C.ar 1 UNL1111 -0.1535 19 C 3.8130 1.9300 1.3570 C.ar 1 UNL1111 -0.1491 20 C 2.5490 1.3459 1.3483 C.ar 1 UNL1111 -0.1513 21 C -0.3613 2.6087 0.1201 C.3 1 UNL1111 -0.0652 22 C -0.4655 3.0879 -1.3302 C.3 1 UNL1111 -0.4679 23 N -5.3286 1.6006 0.0950 N.pl3 1 UNL1111 -0.6340 24 N 2.7804 -4.0010 -0.2285 N.pl3 1 UNL1111 -0.6282 25 H -3.3142 -2.4791 -0.0253 H 1 UNL1111 0.1512 26 H -5.3190 -1.0622 0.0364 H 1 UNL1111 0.1590 27 H -2.8469 2.4575 0.1977 H 1 UNL1111 0.1671 28 H 2.6875 -1.3565 0.0046 H 1 UNL1111 0.1654 29 H 0.2857 -4.9364 -0.1791 H 1 UNL1111 0.1506 30 H -1.7605 -3.5772 -0.0803 H 1 UNL1111 0.1457 31 H 2.1553 0.9538 -2.0133 H 1 UNL1111 0.1620 32 H 4.4088 2.0076 -1.9911 H 1 UNL1111 0.1480 33 H 5.4670 2.6271 0.1661 H 1 UNL1111 0.1447 34 H 4.2817 2.1950 2.3022 H 1 UNL1111 0.1470 35 H 2.0256 1.1441 2.2820 H 1 UNL1111 0.1623 36 H 0.6176 2.9154 0.5583 H 1 UNL1111 0.1579 37 H -1.1313 3.0967 0.7602 H 1 UNL1111 0.1447 38 H -0.3780 4.1770 -1.3943 H 1 UNL1111 0.1498 39 H 0.3291 2.6516 -1.9499 H 1 UNL1111 0.1607 40 H -1.4215 2.7966 -1.7848 H 1 UNL1111 0.1628 41 H -5.2460 2.5666 0.3238 H 1 UNL1111 0.2917 42 H -6.2221 1.1917 0.2589 H 1 UNL1111 0.2932 43 H 2.7208 -4.9750 -0.0224 H 1 UNL1111 0.2823 44 H 3.6534 -3.5797 0.0122 H 1 UNL1111 0.2853 @BOND 1 1 2 ar 2 1 13 ar 3 1 25 1 4 2 3 ar 5 2 26 1 6 3 4 ar 7 3 23 1 8 4 14 ar 9 4 27 1 10 5 6 ar 11 5 14 ar 12 5 21 1 13 6 11 ar 14 6 15 1 15 7 8 ar 16 7 11 ar 17 7 28 1 18 8 9 ar 19 8 24 1 20 9 10 ar 21 9 29 1 22 10 12 ar 23 10 30 1 24 11 12 ar 25 12 13 ar 26 13 14 ar 27 15 16 ar 28 15 20 ar 29 16 17 ar 30 16 31 1 31 17 18 ar 32 17 32 1 33 18 19 ar 34 18 33 1 35 19 20 ar 36 19 34 1 37 20 35 1 38 21 22 1 39 21 36 1 40 21 37 1 41 22 38 1 42 22 39 1 43 22 40 1 44 23 41 1 45 23 42 1 46 24 43 1 47 24 44 1