@MOLECULE 6-carbamimidoyl-n-[(4r)-4-ethyl-1,2,3,4-tetrahydro-6-isoquinolinyl]-2-naphthamide 52 55 0 0 0 SMALL GASTEIGER @ATOM 1 C -5.8254 3.9127 -0.2475 C.3 1 UNL1111 -0.4350 2 C -4.9826 2.6758 -0.5595 C.3 1 UNL1111 -0.2638 3 C -5.5420 1.4116 0.1173 C.3 1 UNL1111 -0.1253 4 C -6.9110 1.0601 -0.5120 C.3 1 UNL1111 -0.1155 5 N -7.4252 -0.1551 0.1495 N.3 1 UNL1111 -0.5379 6 C -6.6030 -1.3406 -0.1813 C.3 1 UNL1111 -0.1099 7 C -5.1269 -1.0636 -0.1014 C.ar 1 UNL1111 -0.0699 8 C -4.6109 0.2318 0.0277 C.ar 1 UNL1111 0.0498 9 C -3.2329 0.4075 0.1342 C.ar 1 UNL1111 -0.2879 10 C -2.3654 -0.6965 0.0809 C.ar 1 UNL1111 0.2232 11 N -0.9813 -0.4208 0.1815 N.am 1 UNL1111 -0.5666 12 C 0.0229 -1.3744 0.3313 C.2 1 UNL1111 0.5839 13 O -0.1924 -2.5634 0.3607 O.2 1 UNL1111 -0.4819 14 C 1.3953 -0.7976 0.4309 C.ar 1 UNL1111 -0.1327 15 C 1.6900 0.1665 1.4270 C.ar 1 UNL1111 -0.1397 16 C 2.9552 0.6844 1.5191 C.ar 1 UNL1111 -0.1406 17 C 3.9743 0.2617 0.6203 C.ar 1 UNL1111 -0.0008 18 C 5.2866 0.8039 0.6862 C.ar 1 UNL1111 -0.1139 19 C 6.2503 0.3801 -0.1953 C.ar 1 UNL1111 -0.0470 20 C 5.9656 -0.6253 -1.1560 C.ar 1 UNL1111 -0.1400 21 C 4.7069 -1.1605 -1.2336 C.ar 1 UNL1111 -0.1475 22 C 3.6805 -0.7179 -0.3538 C.ar 1 UNL1111 -0.0081 23 C 2.3631 -1.2469 -0.4307 C.ar 1 UNL1111 -0.0960 24 C 7.6154 0.9670 -0.1362 C.2 1 UNL1111 0.4170 25 N 8.1366 1.3735 -1.3767 N.pl3 1 UNL1111 -0.7089 26 N 8.2389 1.0363 0.9865 N.2 1 UNL1111 -0.6163 27 C -2.8820 -1.9872 -0.0725 C.ar 1 UNL1111 -0.2164 28 C -4.2590 -2.1555 -0.1555 C.ar 1 UNL1111 -0.1286 29 H -5.3418 4.8224 -0.6215 H 1 UNL1111 0.1414 30 H -6.8169 3.8599 -0.7091 H 1 UNL1111 0.1408 31 H -5.9702 4.0361 0.8324 H 1 UNL1111 0.1464 32 H -4.9171 2.5199 -1.6528 H 1 UNL1111 0.1413 33 H -3.9432 2.8586 -0.2229 H 1 UNL1111 0.1379 34 H -5.7059 1.6163 1.2100 H 1 UNL1111 0.1703 35 H -7.6328 1.8844 -0.3271 H 1 UNL1111 0.1388 36 H -6.8064 0.9492 -1.6116 H 1 UNL1111 0.1175 37 H -8.4006 -0.3190 -0.0944 H 1 UNL1111 0.2540 38 H -6.8754 -2.1259 0.5679 H 1 UNL1111 0.1565 39 H -6.8409 -1.7530 -1.1900 H 1 UNL1111 0.1212 40 H -2.8246 1.4058 0.2713 H 1 UNL1111 0.1572 41 H -0.7174 0.5602 0.1570 H 1 UNL1111 0.3143 42 H 0.9083 0.4721 2.1225 H 1 UNL1111 0.1618 43 H 3.2047 1.4209 2.2826 H 1 UNL1111 0.1612 44 H 5.5211 1.5479 1.4511 H 1 UNL1111 0.1755 45 H 6.7647 -0.9709 -1.8129 H 1 UNL1111 0.1665 46 H 4.4739 -1.9350 -1.9640 H 1 UNL1111 0.1619 47 H 2.1390 -2.0142 -1.1748 H 1 UNL1111 0.1710 48 H 8.9721 1.9169 -1.4081 H 1 UNL1111 0.2952 49 H 7.5298 1.4775 -2.1618 H 1 UNL1111 0.3009 50 H 9.1630 1.4156 1.0603 H 1 UNL1111 0.2735 51 H -2.2263 -2.8585 -0.1201 H 1 UNL1111 0.1975 52 H -4.6629 -3.1630 -0.2598 H 1 UNL1111 0.1536 @BOND 1 1 2 1 2 1 29 1 3 1 30 1 4 1 31 1 5 2 3 1 6 2 32 1 7 2 33 1 8 3 4 1 9 3 8 1 10 3 34 1 11 4 5 1 12 4 35 1 13 4 36 1 14 5 6 1 15 5 37 1 16 6 7 1 17 6 38 1 18 6 39 1 19 7 8 ar 20 7 28 ar 21 8 9 ar 22 9 10 ar 23 9 40 1 24 10 11 1 25 10 27 ar 26 11 12 am 27 11 41 1 28 12 13 2 29 12 14 1 30 14 15 ar 31 14 23 ar 32 15 16 ar 33 15 42 1 34 16 17 ar 35 16 43 1 36 17 18 ar 37 17 22 ar 38 18 19 ar 39 18 44 1 40 19 20 ar 41 19 24 1 42 20 21 ar 43 20 45 1 44 21 22 ar 45 21 46 1 46 22 23 ar 47 23 47 1 48 24 25 1 49 24 26 2 50 25 48 1 51 25 49 1 52 26 50 1 53 27 28 ar 54 27 51 1 55 28 52 1