@MOLECULE 4-[(1r,3as,4r,6as)-5-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-2,3,3-trimethyl-6-oxooctahydropyrrolo[3,4-c]pyrrol-1-yl]benzenecarboximidamide 65 69 0 0 0 SMALL GASTEIGER @ATOM 1 N -5.2573 -0.5395 1.5967 N.pl3 1 UNL1111111111 -0.7167 2 C -5.2500 0.5060 0.6596 C.2 1 UNL1111111111 0.4277 3 N -6.3025 1.0552 0.1603 N.2 1 UNL1111111111 -0.6411 4 C -3.8928 0.9276 0.2274 C.ar 1 UNL1111111111 -0.0572 5 C -3.5391 2.2763 0.2757 C.ar 1 UNL1111111111 -0.0945 6 C -2.2591 2.6679 -0.1076 C.ar 1 UNL1111111111 -0.1688 7 C -1.3366 1.7128 -0.5416 C.ar 1 UNL1111111111 0.0069 8 C 0.0368 2.1678 -0.9691 C.3 1 UNL1111111111 0.0462 9 C 1.0261 2.3465 0.2068 C.3 1 UNL1111111111 -0.2344 10 C 2.4147 1.9214 -0.3407 C.3 1 UNL1111111111 -0.1909 11 C 2.1569 1.3198 -1.7657 C.3 1 UNL1111111111 0.2587 12 C 2.7330 2.3093 -2.8046 C.3 1 UNL1111111111 -0.5051 13 C 2.7770 -0.0620 -2.0112 C.3 1 UNL1111111111 -0.4718 14 N 0.6816 1.1510 -1.8420 N.3 1 UNL1111111111 -0.4678 15 C 0.1131 1.1348 -3.1982 C.3 1 UNL1111111111 -0.2595 16 C 3.0195 0.9564 0.7225 C.3 1 UNL1111111111 0.0707 17 N 1.9448 0.7408 1.7137 N.am 1 UNL1111111111 -0.5076 18 C 1.8548 -0.5577 2.3857 C.3 1 UNL1111111111 -0.0652 19 C 1.4323 -1.6424 1.4247 C.ar 1 UNL1111111111 -0.0446 20 C 2.3855 -2.4605 0.8281 C.ar 1 UNL1111111111 -0.1711 21 C 2.0370 -3.4187 -0.1436 C.ar 1 UNL1111111111 -0.1958 22 C 0.7034 -3.4988 -0.4597 C.ar 1 UNL1111111111 0.1347 23 C -0.2676 -2.6793 0.1632 C.ar 1 UNL1111111111 0.1308 24 C 0.0612 -1.7464 1.1127 C.ar 1 UNL1111111111 -0.1791 25 O -1.5142 -2.9571 -0.3414 O.3 1 UNL1111111111 -0.3363 26 C -1.2998 -3.9797 -1.3397 C.3 1 UNL1111111111 0.1619 27 O 0.1043 -4.3227 -1.3805 O.3 1 UNL1111111111 -0.3503 28 C 0.7651 1.4172 1.3812 C.2 1 UNL1111111111 0.5877 29 O -0.2481 1.3108 2.0266 O.2 1 UNL1111111111 -0.4981 30 C 4.2434 1.6101 1.4045 C.3 1 UNL1111111111 -0.2798 31 C 5.1048 0.5863 2.1405 C.3 1 UNL1111111111 -0.4343 32 C -1.7015 0.3675 -0.5990 C.ar 1 UNL1111111111 -0.1468 33 C -2.9792 -0.0280 -0.2194 C.ar 1 UNL1111111111 -0.1292 34 H -6.0926 -0.7858 2.0761 H 1 UNL1111111111 0.2934 35 H -4.4010 -0.8264 2.0233 H 1 UNL1111111111 0.3082 36 H -7.2242 0.7762 0.4340 H 1 UNL1111111111 0.2685 37 H -4.2688 3.0174 0.6033 H 1 UNL1111111111 0.1629 38 H -1.9808 3.7177 -0.0590 H 1 UNL1111111111 0.1490 39 H -0.0581 3.1552 -1.5002 H 1 UNL1111111111 0.1282 40 H 1.0156 3.3951 0.5686 H 1 UNL1111111111 0.1690 41 H 3.0708 2.8103 -0.4407 H 1 UNL1111111111 0.1506 42 H 2.5956 1.9423 -3.8268 H 1 UNL1111111111 0.1537 43 H 2.2534 3.2901 -2.7371 H 1 UNL1111111111 0.1490 44 H 3.8090 2.4470 -2.6601 H 1 UNL1111111111 0.1495 45 H 2.6075 -0.3960 -3.0412 H 1 UNL1111111111 0.1541 46 H 3.8556 -0.0593 -1.8366 H 1 UNL1111111111 0.1434 47 H 2.3097 -0.8242 -1.3673 H 1 UNL1111111111 0.1723 48 H -0.9648 0.8954 -3.1243 H 1 UNL1111111111 0.1583 49 H 0.2166 2.0796 -3.7523 H 1 UNL1111111111 0.1190 50 H 0.5874 0.3274 -3.7800 H 1 UNL1111111111 0.1454 51 H 3.3305 -0.0174 0.2745 H 1 UNL1111111111 0.1526 52 H 2.8369 -0.7882 2.8582 H 1 UNL1111111111 0.1481 53 H 1.1172 -0.4615 3.2236 H 1 UNL1111111111 0.1752 54 H 3.4340 -2.3639 1.1059 H 1 UNL1111111111 0.1548 55 H 2.7838 -4.0491 -0.6122 H 1 UNL1111111111 0.1697 56 H -0.6784 -1.0938 1.5803 H 1 UNL1111111111 0.2019 57 H -1.5699 -3.5544 -2.3167 H 1 UNL1111111111 0.1434 58 H -1.8538 -4.8743 -1.0274 H 1 UNL1111111111 0.1370 59 H 3.9032 2.3946 2.1088 H 1 UNL1111111111 0.1552 60 H 4.8582 2.1226 0.6403 H 1 UNL1111111111 0.1362 61 H 6.0192 1.0500 2.5284 H 1 UNL1111111111 0.1412 62 H 4.5742 0.1567 2.9987 H 1 UNL1111111111 0.1475 63 H 5.4088 -0.2366 1.4848 H 1 UNL1111111111 0.1400 64 H -0.9773 -0.3772 -0.9407 H 1 UNL1111111111 0.1796 65 H -3.2601 -1.0800 -0.2762 H 1 UNL1111111111 0.1640 @BOND 1 1 2 1 2 1 34 1 3 1 35 1 4 2 3 2 5 2 4 1 6 3 36 1 7 4 5 ar 8 4 33 ar 9 5 6 ar 10 5 37 1 11 6 7 ar 12 6 38 1 13 7 8 1 14 7 32 ar 15 8 9 1 16 8 14 1 17 8 39 1 18 9 10 1 19 9 28 1 20 9 40 1 21 10 11 1 22 10 16 1 23 10 41 1 24 11 12 1 25 11 13 1 26 11 14 1 27 12 42 1 28 12 43 1 29 12 44 1 30 13 45 1 31 13 46 1 32 13 47 1 33 14 15 1 34 15 48 1 35 15 49 1 36 15 50 1 37 16 17 1 38 16 30 1 39 16 51 1 40 17 18 1 41 17 28 am 42 18 19 1 43 18 52 1 44 18 53 1 45 19 20 ar 46 19 24 ar 47 20 21 ar 48 20 54 1 49 21 22 ar 50 21 55 1 51 22 23 ar 52 22 27 1 53 23 24 ar 54 23 25 1 55 24 56 1 56 25 26 1 57 26 27 1 58 26 57 1 59 26 58 1 60 28 29 2 61 30 31 1 62 30 59 1 63 30 60 1 64 31 61 1 65 31 62 1 66 31 63 1 67 32 33 ar 68 32 64 1 69 33 65 1