@MOLECULE viridenomycin 78 80 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.5897 -2.1481 -0.5791 O.3 1 UNL1 -0.5360 2 C 3.3086 -1.1891 -1.3015 C.2 1 UNL1 0.6828 3 C 4.2538 -0.5527 -0.4230 C.2 1 UNL1 -0.4095 4 C 4.6742 -0.9784 0.7926 C.2 1 UNL1 0.3347 5 C 5.6278 -0.0180 1.4770 C.3 1 UNL1 0.0031 6 C 5.8644 1.0783 0.3821 C.3 1 UNL1 0.1181 7 C 4.7656 0.8462 -0.7225 C.3 1 UNL1 0.0717 8 C 3.5955 1.7653 -0.4809 C.2 1 UNL1 -0.1614 9 C 2.5871 1.9046 -1.3520 C.2 1 UNL1 -0.1756 10 C 1.3610 2.6124 -1.0185 C.2 1 UNL1 -0.1506 11 C 0.2383 2.4511 -1.7356 C.2 1 UNL1 -0.1628 12 C -1.0335 3.0683 -1.3757 C.2 1 UNL1 -0.1273 13 C -1.7326 2.7800 -0.2674 C.2 1 UNL1 -0.1726 14 C -1.3075 1.8057 0.7283 C.2 1 UNL1 -0.0646 15 C -2.0168 1.5023 1.8224 C.2 1 UNL1 -0.2833 16 C -3.2910 2.1763 2.1579 C.2 1 UNL1 0.5953 17 N -4.4764 1.4803 1.9619 N.am 1 UNL1 -0.6271 18 C -4.5512 0.2018 1.2414 C.3 1 UNL1 0.0983 19 C -5.7818 -0.5758 1.7746 C.3 1 UNL1 -0.3040 20 C -6.1224 -1.8046 0.9986 C.2 1 UNL1 -0.1341 21 C -5.2981 -2.8105 0.6778 C.2 1 UNL1 -0.1761 22 C -3.8720 -2.8399 0.9627 C.2 1 UNL1 -0.1512 23 C -2.9948 -3.3515 0.0821 C.2 1 UNL1 -0.1580 24 C -1.5580 -3.2232 0.2461 C.2 1 UNL1 -0.1864 25 C -0.6821 -3.7904 -0.5992 C.2 1 UNL1 -0.0919 26 C 0.7489 -3.5235 -0.5264 C.2 1 UNL1 -0.3321 27 C 1.2458 -2.3123 -0.8211 C.2 1 UNL1 0.3340 28 O 3.0741 -1.0175 -2.4637 O.2 1 UNL1 -0.4614 29 O 4.3711 -2.0974 1.4338 O.2 1 UNL1 -0.4361 30 O 4.9724 0.6579 2.5219 O.3 1 UNL1 -0.3490 31 C 4.9067 -0.0825 3.7300 C.3 1 UNL1 -0.2032 32 O 7.1674 0.9539 -0.1004 O.3 1 UNL1 -0.5319 33 C 5.3577 0.9898 -2.1157 C.3 1 UNL1 -0.4448 34 O -3.3590 3.2912 2.6374 O.2 1 UNL1 -0.5219 35 C -4.6288 0.4317 -0.2530 C.ar 1 UNL1 -0.0443 36 C -3.6515 -0.1325 -1.0745 C.ar 1 UNL1 -0.1536 37 C -3.6869 0.0796 -2.4501 C.ar 1 UNL1 -0.1430 38 C -4.6975 0.8602 -3.0079 C.ar 1 UNL1 -0.1500 39 C -5.6733 1.4244 -2.1884 C.ar 1 UNL1 -0.1451 40 C -5.6415 1.2099 -0.8120 C.ar 1 UNL1 -0.1524 41 C 0.5186 -1.1152 -1.3037 C.3 1 UNL1 -0.4982 42 H 6.5696 -0.4927 1.8148 H 1 UNL1 0.1623 43 H 5.8464 2.1031 0.8083 H 1 UNL1 0.1716 44 H 3.5778 2.2449 0.4980 H 1 UNL1 0.1585 45 H 2.6199 1.4372 -2.3414 H 1 UNL1 0.1669 46 H 1.3849 3.2517 -0.1335 H 1 UNL1 0.1605 47 H 0.2106 1.8430 -2.6430 H 1 UNL1 0.1576 48 H -1.4090 3.7946 -2.1030 H 1 UNL1 0.1565 49 H -2.6841 3.2847 -0.0702 H 1 UNL1 0.1652 50 H -0.3481 1.3099 0.5384 H 1 UNL1 0.1589 51 H -1.6782 0.7815 2.5649 H 1 UNL1 0.1750 52 H -5.3454 1.9746 2.1188 H 1 UNL1 0.3147 53 H -3.6214 -0.3875 1.4818 H 1 UNL1 0.1573 54 H -6.6601 0.1036 1.8028 H 1 UNL1 0.1495 55 H -5.5931 -0.8524 2.8371 H 1 UNL1 0.1671 56 H -7.1722 -1.8533 0.6977 H 1 UNL1 0.1456 57 H -5.6803 -3.6716 0.1214 H 1 UNL1 0.1530 58 H -3.5534 -2.4003 1.9086 H 1 UNL1 0.1530 59 H -3.3357 -3.8359 -0.8355 H 1 UNL1 0.1521 60 H -1.2153 -2.6003 1.0746 H 1 UNL1 0.1555 61 H -0.9902 -4.4653 -1.3994 H 1 UNL1 0.1516 62 H 1.3861 -4.3547 -0.2347 H 1 UNL1 0.1764 63 H 3.6342 -2.6007 0.9570 H 1 UNL1 0.3713 64 H 4.3228 0.5795 4.3828 H 1 UNL1 0.1498 65 H 5.9075 -0.2421 4.1416 H 1 UNL1 0.1261 66 H 4.3841 -1.0345 3.5854 H 1 UNL1 0.1406 67 H 7.2727 0.1590 -0.6668 H 1 UNL1 0.3207 68 H 6.1074 0.2200 -2.3318 H 1 UNL1 0.1472 69 H 5.8343 1.9710 -2.2428 H 1 UNL1 0.1631 70 H 4.5870 0.8884 -2.8950 H 1 UNL1 0.1715 71 H -2.8619 -0.7480 -0.6430 H 1 UNL1 0.1571 72 H -2.9249 -0.3643 -3.0872 H 1 UNL1 0.1508 73 H -4.7258 1.0291 -4.0822 H 1 UNL1 0.1491 74 H -6.4621 2.0345 -2.6238 H 1 UNL1 0.1503 75 H -6.4056 1.6526 -0.1777 H 1 UNL1 0.1492 76 H 0.8587 -0.1883 -0.8143 H 1 UNL1 0.1757 77 H -0.5676 -1.1944 -1.1388 H 1 UNL1 0.1810 78 H 0.6678 -0.9745 -2.3903 H 1 UNL1 0.1893 @BOND 1 73 38 1 2 72 37 1 3 38 37 ar 4 38 39 ar 5 70 33 1 6 47 11 1 7 74 39 1 8 28 2 2 9 37 36 ar 10 78 41 1 11 45 9 1 12 68 33 1 13 69 33 1 14 39 40 ar 15 33 7 1 16 48 12 1 17 11 12 1 18 11 10 2 19 61 25 1 20 12 13 2 21 9 10 1 22 9 8 2 23 41 77 1 24 41 27 1 25 41 76 1 26 2 1 1 27 2 3 1 28 36 71 1 29 36 35 ar 30 10 46 1 31 59 23 1 32 27 1 1 33 27 26 2 34 40 35 ar 35 40 75 1 36 7 8 1 37 7 3 1 38 7 6 1 39 67 32 1 40 25 26 1 41 25 24 2 42 26 62 1 43 8 44 1 44 3 4 2 45 13 49 1 46 13 14 1 47 35 18 1 48 32 6 1 49 23 24 1 50 23 22 2 51 57 21 1 52 24 60 1 53 6 43 1 54 6 5 1 55 50 14 1 56 21 22 1 57 21 20 2 58 56 20 1 59 14 15 2 60 4 29 1 61 4 5 1 62 63 29 1 63 22 58 1 64 20 19 1 65 18 53 1 66 18 19 1 67 18 17 1 68 5 42 1 69 5 30 1 70 19 54 1 71 19 55 1 72 15 16 1 73 15 51 1 74 17 52 1 75 17 16 am 76 16 34 2 77 30 31 1 78 66 31 1 79 31 65 1 80 31 64 1