@MOLECULE (6alpha,7beta)-7-methoxyabieta-8,11,13-triene-6,11,12-triol 57 59 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.1065 2.4537 1.1331 O.3 1 UNL1111111111 -0.5784 2 O 0.1158 2.4159 -1.2871 O.3 1 UNL1111111111 -0.3723 3 O 0.8439 -2.9514 -0.4305 O.3 1 UNL1111111111 -0.4530 4 O 3.4162 -2.5165 -0.0055 O.3 1 UNL1111111111 -0.5006 5 C -1.9526 0.0973 0.4846 C.3 1 UNL1111111111 -0.2048 6 C -1.1739 -0.8384 -0.4964 C.3 1 UNL1111111111 0.1116 7 C -3.4883 -0.1412 0.5815 C.3 1 UNL1111111111 0.1236 8 C -1.6011 -2.3021 -0.2691 C.3 1 UNL1111111111 -0.2797 9 C -1.6290 1.5594 0.1454 C.3 1 UNL1111111111 0.1069 10 C -3.7717 -1.6478 0.7780 C.3 1 UNL1111111111 -0.2970 11 C -3.1169 -2.4910 -0.3112 C.3 1 UNL1111111111 -0.2638 12 C 0.3072 -0.6438 -0.2036 C.ar 1 UNL1111111111 -0.0765 13 C -0.1162 1.8523 0.0028 C.3 1 UNL1111111111 0.0452 14 C -1.3574 -0.4849 -1.9819 C.3 1 UNL1111111111 -0.4657 15 C 0.7886 0.6529 0.0282 C.ar 1 UNL1111111111 -0.0495 16 C -4.0480 0.5713 1.8348 C.3 1 UNL1111111111 -0.4817 17 C -4.2681 0.3814 -0.6327 C.3 1 UNL1111111111 -0.4676 18 C 1.2506 -1.6748 -0.2000 C.ar 1 UNL1111111111 0.1925 19 C 2.1388 0.9094 0.2545 C.ar 1 UNL1111111111 -0.1587 20 C 3.0811 -0.1202 0.2621 C.ar 1 UNL1111111111 -0.0939 21 C 2.6155 -1.4097 0.0326 C.ar 1 UNL1111111111 0.1193 22 C 4.5398 0.1584 0.4936 C.3 1 UNL1111111111 -0.0494 23 C -0.1864 3.7968 -1.3617 C.3 1 UNL1111111111 -0.2059 24 C 4.7444 0.8111 1.8671 C.3 1 UNL1111111111 -0.4468 25 C 5.0849 1.0553 -0.6255 C.3 1 UNL1111111111 -0.4458 26 H -1.5423 -0.1284 1.5036 H 1 UNL1111111111 0.1465 27 H -2.1737 1.8998 -0.7668 H 1 UNL1111111111 0.1620 28 H -1.2072 -2.6598 0.7019 H 1 UNL1111111111 0.1483 29 H -1.1431 -2.9497 -1.0463 H 1 UNL1111111111 0.1592 30 H -4.8623 -1.8240 0.7932 H 1 UNL1111111111 0.1315 31 H -3.4009 -1.9687 1.7701 H 1 UNL1111111111 0.1371 32 H -3.5164 -2.2227 -1.3063 H 1 UNL1111111111 0.1369 33 H -3.3654 -3.5594 -0.1687 H 1 UNL1111111111 0.1280 34 H 0.1855 2.5838 0.7933 H 1 UNL1111111111 0.1409 35 H -2.4021 -0.5697 -2.2942 H 1 UNL1111111111 0.1467 36 H -1.0178 0.5345 -2.2072 H 1 UNL1111111111 0.1656 37 H -0.7667 -1.1599 -2.6137 H 1 UNL1111111111 0.1543 38 H -3.4548 0.3591 2.7266 H 1 UNL1111111111 0.1351 39 H -4.0828 1.6594 1.6946 H 1 UNL1111111111 0.1664 40 H -5.0756 0.2529 2.0389 H 1 UNL1111111111 0.1414 41 H -4.1959 1.4718 -0.7180 H 1 UNL1111111111 0.1495 42 H -3.9037 -0.0519 -1.5701 H 1 UNL1111111111 0.1494 43 H -5.3322 0.1359 -0.5510 H 1 UNL1111111111 0.1417 44 H 2.4711 1.9356 0.4096 H 1 UNL1111111111 0.1604 45 H -1.9053 2.1334 2.0327 H 1 UNL1111111111 0.3162 46 H 5.1240 -0.8006 0.4796 H 1 UNL1111111111 0.1154 47 H 1.6144 -3.5792 -0.4023 H 1 UNL1111111111 0.3374 48 H -0.1046 4.0093 -2.4342 H 1 UNL1111111111 0.1408 49 H 0.5505 4.3773 -0.7988 H 1 UNL1111111111 0.1184 50 H -1.1993 4.0124 -1.0044 H 1 UNL1111111111 0.1339 51 H 4.3500 -2.2972 0.2453 H 1 UNL1111111111 0.3378 52 H 5.8077 0.9551 2.0843 H 1 UNL1111111111 0.1429 53 H 4.3180 0.1946 2.6669 H 1 UNL1111111111 0.1485 54 H 4.2620 1.7936 1.9230 H 1 UNL1111111111 0.1511 55 H 6.1591 1.2299 -0.5098 H 1 UNL1111111111 0.1431 56 H 4.5896 2.0334 -0.6358 H 1 UNL1111111111 0.1525 57 H 4.9201 0.6030 -1.6111 H 1 UNL1111111111 0.1527 @BOND 1 1 9 1 2 1 45 1 3 2 13 1 4 2 23 1 5 3 18 1 6 3 47 1 7 4 21 1 8 4 51 1 9 5 6 1 10 5 7 1 11 5 9 1 12 5 26 1 13 6 8 1 14 6 12 1 15 6 14 1 16 7 10 1 17 7 16 1 18 7 17 1 19 8 11 1 20 8 28 1 21 8 29 1 22 9 13 1 23 9 27 1 24 10 11 1 25 10 30 1 26 10 31 1 27 11 32 1 28 11 33 1 29 12 15 ar 30 12 18 ar 31 13 15 1 32 13 34 1 33 14 35 1 34 14 36 1 35 14 37 1 36 15 19 ar 37 16 38 1 38 16 39 1 39 16 40 1 40 17 41 1 41 17 42 1 42 17 43 1 43 18 21 ar 44 19 20 ar 45 19 44 1 46 20 21 ar 47 20 22 1 48 22 24 1 49 22 25 1 50 22 46 1 51 23 48 1 52 23 49 1 53 23 50 1 54 24 52 1 55 24 53 1 56 24 54 1 57 25 55 1 58 25 56 1 59 25 57 1