@MOLECULE 4-(aminomethyl)-5-[3-(7,10-dimethyl-3,7,10-triazatricyclo[3.3.3.0~1,5~]undec-3-yl)propyl]-2-methyl-3-pyridinol 59 62 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.7041 -0.9242 1.6925 O.3 1 UNL1111111111 -0.4505 2 N 1.5490 0.3375 -0.9911 N.3 1 UNL1111111111 -0.4334 3 N 4.4727 -2.0025 0.3044 N.3 1 UNL1111111111 -0.4045 4 N 4.6555 1.8974 0.8132 N.3 1 UNL1111111111 -0.4028 5 N -5.1032 1.8820 -0.4489 N.ar 1 UNL1111111111 -0.3443 6 N -3.9955 -3.0728 -0.3675 N.3 1 UNL1111111111 -0.6184 7 C 3.9225 0.1383 -0.6655 C.3 1 UNL1111111111 0.0021 8 C 3.1892 -0.0092 0.7221 C.3 1 UNL1111111111 0.0011 9 C 2.8093 0.0285 -1.7274 C.3 1 UNL1111111111 -0.1386 10 C 1.7060 -0.2320 0.3752 C.3 1 UNL1111111111 -0.1360 11 C 4.9358 -1.0204 -0.7163 C.3 1 UNL1111111111 -0.1412 12 C 4.5860 1.5280 -0.6289 C.3 1 UNL1111111111 -0.1417 13 C 3.8429 -1.2226 1.4036 C.3 1 UNL1111111111 -0.1427 14 C 3.4461 1.3167 1.4603 C.3 1 UNL1111111111 -0.1420 15 C 0.3469 -0.1416 -1.7076 C.3 1 UNL1111111111 -0.1060 16 C 5.5700 -2.8555 0.7964 C.3 1 UNL1111111111 -0.2774 17 C 4.7300 3.3569 1.0058 C.3 1 UNL1111111111 -0.2783 18 C -0.9186 0.3032 -0.9441 C.3 1 UNL1111111111 -0.2658 19 C -2.1803 -0.1421 -1.6986 C.3 1 UNL1111111111 -0.2850 20 C -3.3942 0.2299 -0.9107 C.ar 1 UNL1111111111 -0.0316 21 C -3.9361 -0.6224 0.0604 C.ar 1 UNL1111111111 -0.1739 22 C -4.0119 1.4725 -1.1254 C.ar 1 UNL1111111111 -0.0274 23 C -5.0708 -0.1911 0.7443 C.ar 1 UNL1111111111 0.1532 24 C -3.3464 -1.9698 0.3716 C.3 1 UNL1111111111 -0.1080 25 C -5.6443 1.0794 0.4767 C.ar 1 UNL1111111111 0.1401 26 C -6.8512 1.5359 1.2150 C.3 1 UNL1111111111 -0.4266 27 H 2.8049 -0.9761 -2.1961 H 1 UNL1111111111 0.1312 28 H 2.9186 0.7776 -2.5376 H 1 UNL1111111111 0.1424 29 H 1.0310 0.3244 1.0554 H 1 UNL1111111111 0.1450 30 H 1.4422 -1.3070 0.4366 H 1 UNL1111111111 0.1341 31 H 4.9432 -1.5356 -1.6968 H 1 UNL1111111111 0.1427 32 H 5.9632 -0.6542 -0.5320 H 1 UNL1111111111 0.1328 33 H 5.6189 1.5182 -1.0272 H 1 UNL1111111111 0.1426 34 H 4.0037 2.2578 -1.2296 H 1 UNL1111111111 0.1329 35 H 4.5752 -0.8934 2.1705 H 1 UNL1111111111 0.1345 36 H 3.1037 -1.8761 1.9046 H 1 UNL1111111111 0.1428 37 H 2.5600 1.9817 1.3894 H 1 UNL1111111111 0.1353 38 H 3.6688 1.1702 2.5346 H 1 UNL1111111111 0.1427 39 H 0.3364 -1.2388 -1.8696 H 1 UNL1111111111 0.1155 40 H 0.3568 0.3402 -2.7132 H 1 UNL1111111111 0.1397 41 H 6.3973 -2.3174 1.2824 H 1 UNL1111111111 0.1230 42 H 5.9767 -3.4325 -0.0512 H 1 UNL1111111111 0.1448 43 H 5.1537 -3.5818 1.5169 H 1 UNL1111111111 0.1452 44 H 5.6517 3.7326 0.5315 H 1 UNL1111111111 0.1451 45 H 4.8070 3.5677 2.0856 H 1 UNL1111111111 0.1456 46 H 3.8738 3.9178 0.6020 H 1 UNL1111111111 0.1227 47 H -0.9088 1.4057 -0.8213 H 1 UNL1111111111 0.1613 48 H -0.9201 -0.1112 0.0815 H 1 UNL1111111111 0.1435 49 H -2.2034 0.3184 -2.7080 H 1 UNL1111111111 0.1546 50 H -2.1482 -1.2360 -1.8838 H 1 UNL1111111111 0.1496 51 H -3.6270 2.1828 -1.8654 H 1 UNL1111111111 0.1794 52 H -2.2503 -1.9969 0.1589 H 1 UNL1111111111 0.1678 53 H -3.4208 -2.2011 1.4623 H 1 UNL1111111111 0.1463 54 H -3.7576 -3.0476 -1.3483 H 1 UNL1111111111 0.2504 55 H -5.0007 -3.0316 -0.2934 H 1 UNL1111111111 0.2466 56 H -6.6634 1.5755 2.2974 H 1 UNL1111111111 0.1681 57 H -7.1720 2.5398 0.8946 H 1 UNL1111111111 0.1748 58 H -7.6954 0.8459 1.0586 H 1 UNL1111111111 0.1679 59 H -5.2697 -1.8075 1.8243 H 1 UNL1111111111 0.3287 @BOND 1 1 23 1 2 1 59 1 3 2 9 1 4 2 10 1 5 2 15 1 6 3 11 1 7 3 13 1 8 3 16 1 9 4 12 1 10 4 14 1 11 4 17 1 12 5 22 ar 13 5 25 ar 14 6 24 1 15 6 54 1 16 6 55 1 17 7 8 1 18 7 9 1 19 7 11 1 20 7 12 1 21 8 10 1 22 8 13 1 23 8 14 1 24 9 27 1 25 9 28 1 26 10 29 1 27 10 30 1 28 11 31 1 29 11 32 1 30 12 33 1 31 12 34 1 32 13 35 1 33 13 36 1 34 14 37 1 35 14 38 1 36 15 18 1 37 15 39 1 38 15 40 1 39 16 41 1 40 16 42 1 41 16 43 1 42 17 44 1 43 17 45 1 44 17 46 1 45 18 19 1 46 18 47 1 47 18 48 1 48 19 20 1 49 19 49 1 50 19 50 1 51 20 21 ar 52 20 22 ar 53 21 23 ar 54 21 24 1 55 22 51 1 56 23 25 ar 57 24 52 1 58 24 53 1 59 25 26 1 60 26 56 1 61 26 57 1 62 26 58 1