@MOLECULE methyl (5alpha,19alpha)-16-methoxy-8-oxo-2,3,6,7-tetradehydroaspidospermidine-3-carboxylate 52 56 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.2803 -3.4869 1.2550 O.2 1 UNL1111111111 -0.5260 2 O -2.5510 3.4953 0.3094 O.3 1 UNL1111111111 -0.3869 3 O -0.3310 3.7929 0.4985 O.2 1 UNL1111111111 -0.5823 4 O 5.6358 -0.4994 -0.4017 O.3 1 UNL1111111111 -0.3123 5 N -1.4684 -2.3826 0.4901 N.am 1 UNL1111111111 -0.5125 6 N 1.2512 1.5277 0.5784 N.pl3 1 UNL1111111111 -0.4642 7 C 0.1278 -0.5689 0.5813 C.3 1 UNL1111111111 0.0157 8 C -0.8870 -1.3078 -0.3432 C.3 1 UNL1111111111 0.0721 9 C -1.9531 -0.3575 -0.9693 C.3 1 UNL1111111111 -0.0025 10 C -0.1483 -1.0961 2.0114 C.3 1 UNL1111111111 -0.2953 11 C -0.0150 0.9531 0.5450 C.2 1 UNL1111111111 0.2701 12 C -0.7768 -2.4803 1.7885 C.3 1 UNL1111111111 -0.0639 13 C -2.3806 0.7368 0.0564 C.3 1 UNL1111111111 -0.2366 14 C 1.5851 -0.7389 0.2441 C.ar 1 UNL1111111111 -0.2172 15 C -1.2035 1.5877 0.3894 C.2 1 UNL1111111111 -0.3296 16 C -1.3577 0.3112 -2.2309 C.3 1 UNL1111111111 -0.2672 17 C -3.1965 -1.1090 -1.3548 C.2 1 UNL1111111111 -0.0821 18 C 2.2129 0.5358 0.3087 C.ar 1 UNL1111111111 0.2643 19 C -2.8075 -2.7466 0.4144 C.2 1 UNL1111111111 0.5842 20 C -3.5736 -2.2309 -0.7386 C.2 1 UNL1111111111 -0.2835 21 C 2.3313 -1.8645 -0.0412 C.ar 1 UNL1111111111 -0.0170 22 C -1.0802 -0.6691 -3.3688 C.3 1 UNL1111111111 -0.4374 23 C -1.2776 3.0340 0.4090 C.2 1 UNL1111111111 0.6388 24 C 3.5741 0.7059 0.1074 C.ar 1 UNL1111111111 -0.3878 25 C 3.7018 -1.7282 -0.2591 C.ar 1 UNL1111111111 -0.3159 26 C 4.3002 -0.4600 -0.1755 C.ar 1 UNL1111111111 0.3119 27 C -2.6906 4.9135 0.3228 C.3 1 UNL1111111111 -0.1706 28 C 6.3498 0.7285 -0.3412 C.3 1 UNL1111111111 -0.2017 29 H -0.3262 -1.8186 -1.1721 H 1 UNL1111111111 0.1626 30 H -0.8406 -0.4264 2.5531 H 1 UNL1111111111 0.1611 31 H 0.7725 -1.1484 2.6146 H 1 UNL1111111111 0.1640 32 H -0.0054 -3.2779 1.7221 H 1 UNL1111111111 0.1453 33 H -1.4782 -2.7716 2.6004 H 1 UNL1111111111 0.1664 34 H -2.7946 0.2529 0.9660 H 1 UNL1111111111 0.1619 35 H -3.2117 1.3421 -0.3593 H 1 UNL1111111111 0.1675 36 H -0.4211 0.8425 -1.9693 H 1 UNL1111111111 0.1513 37 H -2.0496 1.1040 -2.5792 H 1 UNL1111111111 0.1485 38 H -3.7818 -0.6648 -2.1609 H 1 UNL1111111111 0.1581 39 H 1.3960 2.5269 0.5445 H 1 UNL1111111111 0.3569 40 H -4.4649 -2.8001 -0.9919 H 1 UNL1111111111 0.1812 41 H 1.8594 -2.8469 -0.0958 H 1 UNL1111111111 0.1634 42 H -0.2767 -1.3726 -3.1195 H 1 UNL1111111111 0.1454 43 H -1.9642 -1.2614 -3.6297 H 1 UNL1111111111 0.1464 44 H -0.7658 -0.1350 -4.2738 H 1 UNL1111111111 0.1458 45 H 4.0379 1.6803 0.1654 H 1 UNL1111111111 0.1794 46 H 4.3175 -2.5927 -0.4902 H 1 UNL1111111111 0.1764 47 H -2.1639 5.3541 -0.5302 H 1 UNL1111111111 0.1392 48 H -2.3019 5.3239 1.2610 H 1 UNL1111111111 0.1416 49 H -3.7744 5.0520 0.2429 H 1 UNL1111111111 0.1433 50 H 6.2858 1.1693 0.6586 H 1 UNL1111111111 0.1380 51 H 5.9997 1.4225 -1.1118 H 1 UNL1111111111 0.1375 52 H 7.3789 0.4066 -0.5535 H 1 UNL1111111111 0.1543 @BOND 1 1 19 2 2 2 23 1 3 2 27 1 4 3 23 2 5 4 26 1 6 4 28 1 7 5 8 1 8 5 12 1 9 5 19 am 10 6 11 1 11 6 18 1 12 6 39 1 13 7 8 1 14 7 10 1 15 7 11 1 16 7 14 1 17 8 9 1 18 8 29 1 19 9 13 1 20 9 16 1 21 9 17 1 22 10 12 1 23 10 30 1 24 10 31 1 25 11 15 2 26 12 32 1 27 12 33 1 28 13 15 1 29 13 34 1 30 13 35 1 31 14 18 ar 32 14 21 ar 33 15 23 1 34 16 22 1 35 16 36 1 36 16 37 1 37 17 20 2 38 17 38 1 39 18 24 ar 40 19 20 1 41 20 40 1 42 21 25 ar 43 21 41 1 44 22 42 1 45 22 43 1 46 22 44 1 47 24 26 ar 48 24 45 1 49 25 26 ar 50 25 46 1 51 27 47 1 52 27 48 1 53 27 49 1 54 28 50 1 55 28 51 1 56 28 52 1