@MOLECULE 4-({4-[2-(4-chlorophenyl)-2-hydroxyethyl]-1-piperazinyl}methyl)-2,6-bis(2-methyl-2-propanyl)phenol 71 73 0 0 0 SMALL GASTEIGER @ATOM 1 CL -9.3474 -1.4486 -0.7500 Cl 1 UNL1111111111 -0.0981 2 O 5.9334 -1.4792 -1.0487 O.3 1 UNL1111111111 -0.4969 3 O -4.0519 2.3881 -0.3517 O.3 1 UNL1111111111 -0.5597 4 N 0.9230 1.2596 1.5364 N.3 1 UNL1111111111 -0.4239 5 N -1.8793 1.1436 0.9346 N.3 1 UNL1111111111 -0.4358 6 C 0.4490 1.1948 0.1333 C.3 1 UNL1111111111 -0.1223 7 C -0.0519 2.0246 2.3484 C.3 1 UNL1111111111 -0.1243 8 C -0.8811 0.4101 0.1162 C.3 1 UNL1111111111 -0.1221 9 C -1.3995 1.2609 2.3340 C.3 1 UNL1111111111 -0.1170 10 C 2.2832 1.8530 1.6201 C.3 1 UNL1111111111 -0.1146 11 C 6.1419 1.2026 -1.5853 C.3 1 UNL1111111111 0.1468 12 C 3.9905 -2.7932 0.7292 C.3 1 UNL1111111111 0.1337 13 C 3.2661 0.9486 0.9222 C.ar 1 UNL1111111111 -0.0750 14 C 5.1100 0.6540 -0.6211 C.ar 1 UNL1111111111 -0.0937 15 C 4.0858 -1.2981 0.5080 C.ar 1 UNL1111111111 -0.1628 16 C -3.2022 0.4794 0.8771 C.3 1 UNL1111111111 -0.1864 17 C 5.0259 -0.7299 -0.3667 C.ar 1 UNL1111111111 0.2521 18 C 4.2050 1.4797 0.0389 C.ar 1 UNL1111111111 -0.1518 19 C 3.2196 -0.4224 1.1604 C.ar 1 UNL1111111111 -0.1113 20 C -3.9095 0.9823 -0.4112 C.3 1 UNL1111111111 0.1470 21 C 6.0596 2.7369 -1.7246 C.3 1 UNL1111111111 -0.4659 22 C 7.5520 0.8569 -1.0730 C.3 1 UNL1111111111 -0.4602 23 C 5.9059 0.5928 -2.9796 C.3 1 UNL1111111111 -0.4599 24 C 2.8695 -3.1750 1.7169 C.3 1 UNL1111111111 -0.4552 25 C 5.3140 -3.3158 1.3222 C.3 1 UNL1111111111 -0.4668 26 C 3.6680 -3.4888 -0.6086 C.3 1 UNL1111111111 -0.4689 27 C -5.2871 0.3880 -0.5040 C.ar 1 UNL1111111111 -0.0502 28 C -5.4220 -0.9486 -0.8888 C.ar 1 UNL1111111111 -0.1528 29 C -6.4129 1.1570 -0.2073 C.ar 1 UNL1111111111 -0.1018 30 C -6.6861 -1.5282 -0.9662 C.ar 1 UNL1111111111 -0.1696 31 C -7.6844 0.5911 -0.2859 C.ar 1 UNL1111111111 -0.1762 32 C -7.7890 -0.7414 -0.6606 C.ar 1 UNL1111111111 0.0258 33 H 0.3074 2.1972 -0.3226 H 1 UNL1111111111 0.1264 34 H 1.2060 0.6548 -0.4772 H 1 UNL1111111111 0.1533 35 H 0.3206 2.0874 3.3923 H 1 UNL1111111111 0.1368 36 H -0.2036 3.0618 1.9815 H 1 UNL1111111111 0.1257 37 H -1.2536 0.3406 -0.9269 H 1 UNL1111111111 0.1360 38 H -0.7060 -0.6246 0.4830 H 1 UNL1111111111 0.1304 39 H -1.2686 0.2718 2.8237 H 1 UNL1111111111 0.1304 40 H -2.1505 1.8334 2.9182 H 1 UNL1111111111 0.1357 41 H 2.3253 2.8860 1.2110 H 1 UNL1111111111 0.1222 42 H 2.5589 1.9246 2.6993 H 1 UNL1111111111 0.1494 43 H -3.1505 -0.6269 0.8881 H 1 UNL1111111111 0.1318 44 H -3.8141 0.7808 1.7558 H 1 UNL1111111111 0.1568 45 H 4.2182 2.5560 -0.1277 H 1 UNL1111111111 0.1585 46 H 2.4653 -0.7899 1.8610 H 1 UNL1111111111 0.1763 47 H -3.3080 0.7602 -1.3242 H 1 UNL1111111111 0.1336 48 H 6.8164 3.1016 -2.4278 H 1 UNL1111111111 0.1449 49 H 5.0844 3.0547 -2.1064 H 1 UNL1111111111 0.1444 50 H 6.2411 3.2378 -0.7686 H 1 UNL1111111111 0.1443 51 H 7.7247 -0.2257 -1.0608 H 1 UNL1111111111 0.1623 52 H 7.7002 1.2236 -0.0526 H 1 UNL1111111111 0.1435 53 H 8.3238 1.2998 -1.7091 H 1 UNL1111111111 0.1407 54 H 6.0754 -0.4906 -2.9825 H 1 UNL1111111111 0.1624 55 H 6.5826 1.0255 -3.7218 H 1 UNL1111111111 0.1402 56 H 4.8781 0.7644 -3.3145 H 1 UNL1111111111 0.1434 57 H 1.8885 -2.8370 1.3636 H 1 UNL1111111111 0.1508 58 H 3.0409 -2.7401 2.7078 H 1 UNL1111111111 0.1500 59 H 2.8110 -4.2610 1.8444 H 1 UNL1111111111 0.1432 60 H 6.1651 -3.2125 0.6411 H 1 UNL1111111111 0.1362 61 H 5.2392 -4.3763 1.5849 H 1 UNL1111111111 0.1492 62 H 5.5690 -2.7647 2.2364 H 1 UNL1111111111 0.1583 63 H 4.4175 -3.3062 -1.3844 H 1 UNL1111111111 0.1413 64 H 2.7109 -3.1279 -1.0066 H 1 UNL1111111111 0.1578 65 H 3.5869 -4.5730 -0.4812 H 1 UNL1111111111 0.1467 66 H 5.8878 -2.4443 -0.8220 H 1 UNL1111111111 0.3302 67 H -3.2174 2.7682 0.0173 H 1 UNL1111111111 0.3453 68 H -4.5414 -1.5408 -1.1320 H 1 UNL1111111111 0.1555 69 H -6.2923 2.2052 0.0807 H 1 UNL1111111111 0.1831 70 H -6.7989 -2.5704 -1.2610 H 1 UNL1111111111 0.1693 71 H -8.5675 1.1866 -0.0575 H 1 UNL1111111111 0.1717 @BOND 1 1 32 1 2 2 17 1 3 2 66 1 4 3 20 1 5 3 67 1 6 4 6 1 7 4 7 1 8 4 10 1 9 5 8 1 10 5 9 1 11 5 16 1 12 6 8 1 13 6 33 1 14 6 34 1 15 7 9 1 16 7 35 1 17 7 36 1 18 8 37 1 19 8 38 1 20 9 39 1 21 9 40 1 22 10 13 1 23 10 41 1 24 10 42 1 25 11 14 1 26 11 21 1 27 11 22 1 28 11 23 1 29 12 15 1 30 12 24 1 31 12 25 1 32 12 26 1 33 13 18 ar 34 13 19 ar 35 14 17 ar 36 14 18 ar 37 15 17 ar 38 15 19 ar 39 16 20 1 40 16 43 1 41 16 44 1 42 18 45 1 43 19 46 1 44 20 27 1 45 20 47 1 46 21 48 1 47 21 49 1 48 21 50 1 49 22 51 1 50 22 52 1 51 22 53 1 52 23 54 1 53 23 55 1 54 23 56 1 55 24 57 1 56 24 58 1 57 24 59 1 58 25 60 1 59 25 61 1 60 25 62 1 61 26 63 1 62 26 64 1 63 26 65 1 64 27 28 ar 65 27 29 ar 66 28 30 ar 67 28 68 1 68 29 31 ar 69 29 69 1 70 30 32 ar 71 30 70 1 72 31 32 ar 73 31 71 1