@MOLECULE 17b-(n-tert-butylcarboxamido)androsta-3,5-diene-3-carboxylic acid 66 69 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.9915 0.9567 0.9090 O.2 1 UNL1111111111 -0.5515 2 O 7.1503 -2.0482 -0.0158 O.3 1 UNL1111111111 -0.5591 3 O 7.6221 0.1124 0.2168 O.2 1 UNL1111111111 -0.5142 4 N -4.7570 -0.7467 -0.5704 N.am 1 UNL1111111111 -0.6542 5 C -1.8395 0.5149 -0.1156 C.3 1 UNL1111111111 0.0887 6 C -0.8482 1.6564 -0.4744 C.3 1 UNL1111111111 -0.1381 7 C 0.5398 1.3875 0.1043 C.3 1 UNL1111111111 -0.1159 8 C 1.0685 0.0659 -0.5097 C.3 1 UNL1111111111 -0.1397 9 C -3.1695 1.1109 -0.6627 C.3 1 UNL1111111111 -0.2395 10 C -1.3501 -0.7516 -0.8263 C.3 1 UNL1111111111 -0.3017 11 C 2.4588 -0.2858 0.0961 C.3 1 UNL1111111111 0.0747 12 C 0.0686 -1.0949 -0.3385 C.3 1 UNL1111111111 -0.2726 13 C -1.5878 2.9283 -0.0338 C.3 1 UNL1111111111 -0.2786 14 C -3.0771 2.6206 -0.3241 C.3 1 UNL1111111111 -0.2542 15 C 1.4897 2.5444 -0.2493 C.3 1 UNL1111111111 -0.3004 16 C -1.9784 0.2626 1.3893 C.3 1 UNL1111111111 -0.4659 17 C 3.3703 0.9193 0.0221 C.2 1 UNL1111111111 -0.0687 18 C 3.0862 -1.4270 -0.7413 C.3 1 UNL1111111111 -0.2876 19 C 2.9238 2.1791 -0.1027 C.2 1 UNL1111111111 -0.1278 20 C 2.3524 -0.7026 1.5724 C.3 1 UNL1111111111 -0.4531 21 C -4.3817 0.4643 -0.0185 C.2 1 UNL1111111111 0.5962 22 C 4.5002 -1.7882 -0.2689 C.3 1 UNL1111111111 -0.2490 23 C 4.8033 0.6614 0.1057 C.2 1 UNL1111111111 -0.0716 24 C 5.3259 -0.5703 -0.0339 C.2 1 UNL1111111111 -0.1331 25 C -5.8716 -1.5574 -0.0269 C.3 1 UNL1111111111 0.3423 26 C 6.7804 -0.7395 0.0691 C.2 1 UNL1111111111 0.6334 27 C -5.9688 -2.8409 -0.8788 C.3 1 UNL1111111111 -0.4964 28 C -5.5793 -1.9302 1.4370 C.3 1 UNL1111111111 -0.4933 29 C -7.1853 -0.7664 -0.1277 C.3 1 UNL1111111111 -0.4882 30 H -0.7487 1.6924 -1.5900 H 1 UNL1111111111 0.1368 31 H 0.4856 1.2910 1.2122 H 1 UNL1111111111 0.1475 32 H 1.2100 0.2381 -1.6049 H 1 UNL1111111111 0.1385 33 H -3.2158 0.9864 -1.7668 H 1 UNL1111111111 0.1497 34 H -1.3494 -0.6100 -1.9217 H 1 UNL1111111111 0.1362 35 H -2.0254 -1.6016 -0.6225 H 1 UNL1111111111 0.1361 36 H 0.0211 -1.4005 0.7241 H 1 UNL1111111111 0.1475 37 H 0.4338 -1.9809 -0.8912 H 1 UNL1111111111 0.1336 38 H -1.2412 3.8175 -0.5782 H 1 UNL1111111111 0.1320 39 H -1.4282 3.1334 1.0371 H 1 UNL1111111111 0.1428 40 H -3.7048 2.8656 0.5541 H 1 UNL1111111111 0.1685 41 H -3.4606 3.2307 -1.1545 H 1 UNL1111111111 0.1341 42 H 1.2466 3.4243 0.3828 H 1 UNL1111111111 0.1539 43 H 1.3104 2.8785 -1.2956 H 1 UNL1111111111 0.1558 44 H -2.4352 1.1223 1.8990 H 1 UNL1111111111 0.1661 45 H -2.6220 -0.6022 1.5904 H 1 UNL1111111111 0.1501 46 H -1.0142 0.0730 1.8699 H 1 UNL1111111111 0.1493 47 H 3.1214 -1.1195 -1.8044 H 1 UNL1111111111 0.1440 48 H 2.4443 -2.3251 -0.7011 H 1 UNL1111111111 0.1396 49 H 3.6119 3.0256 -0.1310 H 1 UNL1111111111 0.1481 50 H 1.7780 0.0267 2.1538 H 1 UNL1111111111 0.1479 51 H 1.8721 -1.6791 1.6843 H 1 UNL1111111111 0.1443 52 H 3.3448 -0.7726 2.0351 H 1 UNL1111111111 0.1556 53 H 4.9851 -2.4544 -1.0158 H 1 UNL1111111111 0.1614 54 H 4.4556 -2.3921 0.6642 H 1 UNL1111111111 0.1590 55 H 5.4501 1.5293 0.2817 H 1 UNL1111111111 0.1681 56 H -4.2202 -1.1558 -1.3168 H 1 UNL1111111111 0.3063 57 H -5.0535 -3.4381 -0.8216 H 1 UNL1111111111 0.1488 58 H -6.7905 -3.4731 -0.5242 H 1 UNL1111111111 0.1589 59 H -6.1670 -2.6133 -1.9314 H 1 UNL1111111111 0.1514 60 H -5.5217 -1.0267 2.0640 H 1 UNL1111111111 0.1809 61 H -4.6276 -2.4587 1.5378 H 1 UNL1111111111 0.1464 62 H -6.3686 -2.5641 1.8493 H 1 UNL1111111111 0.1489 63 H -7.3892 -0.4525 -1.1557 H 1 UNL1111111111 0.1495 64 H -8.0337 -1.3578 0.2256 H 1 UNL1111111111 0.1465 65 H -7.1392 0.1470 0.4864 H 1 UNL1111111111 0.1824 66 H 8.1283 -2.1764 0.0517 H 1 UNL1111111111 0.3529 @BOND 1 1 21 2 2 2 26 1 3 2 66 1 4 3 26 2 5 4 21 am 6 4 25 1 7 4 56 1 8 5 6 1 9 5 9 1 10 5 10 1 11 5 16 1 12 6 7 1 13 6 13 1 14 6 30 1 15 7 8 1 16 7 15 1 17 7 31 1 18 8 11 1 19 8 12 1 20 8 32 1 21 9 14 1 22 9 21 1 23 9 33 1 24 10 12 1 25 10 34 1 26 10 35 1 27 11 17 1 28 11 18 1 29 11 20 1 30 12 36 1 31 12 37 1 32 13 14 1 33 13 38 1 34 13 39 1 35 14 40 1 36 14 41 1 37 15 19 1 38 15 42 1 39 15 43 1 40 16 44 1 41 16 45 1 42 16 46 1 43 17 19 2 44 17 23 1 45 18 22 1 46 18 47 1 47 18 48 1 48 19 49 1 49 20 50 1 50 20 51 1 51 20 52 1 52 22 24 1 53 22 53 1 54 22 54 1 55 23 24 2 56 23 55 1 57 24 26 1 58 25 27 1 59 25 28 1 60 25 29 1 61 27 57 1 62 27 58 1 63 27 59 1 64 28 60 1 65 28 61 1 66 28 62 1 67 29 63 1 68 29 64 1 69 29 65 1