@MOLECULE 1-(isopropylamino)-3-(1-naphthyloxy)-2-propanyl pivalate 54 55 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.4459 -0.4812 0.2743 O.3 1 UNL1111111111 -0.4404 2 O 0.0500 0.2100 -0.4597 O.3 1 UNL1111111111 -0.3239 3 O -3.7391 0.0931 -1.4697 O.2 1 UNL1111111111 -0.5248 4 N -0.1094 -3.1932 -0.3374 N.3 1 UNL1111111111 -0.5774 5 C -1.6890 -1.3600 -0.5587 C.3 1 UNL1111111111 0.1111 6 C -3.8784 1.3606 0.6263 C.3 1 UNL1111111111 0.0557 7 C -0.9570 -2.2772 0.4513 C.3 1 UNL1111111111 -0.1288 8 C -0.7204 -0.5303 -1.4114 C.3 1 UNL1111111111 -0.0849 9 C 0.9311 -3.9201 0.4406 C.3 1 UNL1111111111 0.1132 10 C -3.3916 0.2829 -0.3331 C.2 1 UNL1111111111 0.5938 11 C -2.6527 2.1527 1.0911 C.3 1 UNL1111111111 -0.4509 12 C -4.8564 2.2751 -0.1124 C.3 1 UNL1111111111 -0.4547 13 C -4.5662 0.6624 1.8030 C.3 1 UNL1111111111 -0.4562 14 C 1.8487 -2.9525 1.1980 C.3 1 UNL1111111111 -0.4655 15 C 1.7591 -4.7243 -0.5796 C.3 1 UNL1111111111 -0.4648 16 C 1.1789 0.7959 -0.9272 C.ar 1 UNL1111111111 0.2611 17 C 2.1162 1.0871 0.1153 C.ar 1 UNL1111111111 -0.0992 18 C 3.3395 1.6909 -0.2431 C.ar 1 UNL1111111111 0.0557 19 C 1.4155 1.1461 -2.2363 C.ar 1 UNL1111111111 -0.3217 20 C 1.8447 0.7823 1.4716 C.ar 1 UNL1111111111 -0.1034 21 C 3.5702 2.0604 -1.5973 C.ar 1 UNL1111111111 -0.2429 22 C 2.6222 1.8138 -2.5575 C.ar 1 UNL1111111111 -0.0645 23 C 4.3102 1.9238 0.7693 C.ar 1 UNL1111111111 -0.1842 24 C 2.7811 1.0570 2.4364 C.ar 1 UNL1111111111 -0.1839 25 C 4.0318 1.6168 2.0771 C.ar 1 UNL1111111111 -0.1190 26 H -2.3874 -1.9326 -1.2096 H 1 UNL1111111111 0.1445 27 H -0.3218 -1.6488 1.1161 H 1 UNL1111111111 0.1697 28 H -1.6981 -2.7928 1.0966 H 1 UNL1111111111 0.1204 29 H -1.2508 0.1857 -2.0630 H 1 UNL1111111111 0.1461 30 H -0.0601 -1.1943 -2.0038 H 1 UNL1111111111 0.1631 31 H 0.4631 -4.6218 1.1796 H 1 UNL1111111111 0.0989 32 H -0.6823 -3.8551 -0.8592 H 1 UNL1111111111 0.2538 33 H -1.9060 1.4981 1.5587 H 1 UNL1111111111 0.1688 34 H -2.9263 2.9176 1.8249 H 1 UNL1111111111 0.1503 35 H -2.1489 2.6581 0.2523 H 1 UNL1111111111 0.1572 36 H -5.7132 1.7135 -0.5090 H 1 UNL1111111111 0.1585 37 H -5.2424 3.0565 0.5497 H 1 UNL1111111111 0.1510 38 H -4.3816 2.7689 -0.9679 H 1 UNL1111111111 0.1588 39 H -5.4612 0.1150 1.4843 H 1 UNL1111111111 0.1509 40 H -4.8761 1.3833 2.5651 H 1 UNL1111111111 0.1534 41 H -3.8898 -0.0562 2.2830 H 1 UNL1111111111 0.1615 42 H 2.7728 -3.4463 1.5147 H 1 UNL1111111111 0.1473 43 H 2.1329 -2.0987 0.5670 H 1 UNL1111111111 0.1715 44 H 1.3677 -2.5521 2.0998 H 1 UNL1111111111 0.1416 45 H 1.1467 -5.4310 -1.1454 H 1 UNL1111111111 0.1389 46 H 2.5514 -5.2906 -0.0822 H 1 UNL1111111111 0.1443 47 H 2.2329 -4.0484 -1.3037 H 1 UNL1111111111 0.1657 48 H 0.7031 0.9373 -3.0249 H 1 UNL1111111111 0.1680 49 H 0.8832 0.3357 1.7292 H 1 UNL1111111111 0.1637 50 H 4.5082 2.5521 -1.8511 H 1 UNL1111111111 0.1553 51 H 2.7852 2.1267 -3.5896 H 1 UNL1111111111 0.1464 52 H 5.2671 2.3563 0.4865 H 1 UNL1111111111 0.1535 53 H 2.5752 0.8520 3.4835 H 1 UNL1111111111 0.1514 54 H 4.7661 1.8037 2.8586 H 1 UNL1111111111 0.1461 @BOND 1 1 5 1 2 1 10 1 3 2 8 1 4 2 16 1 5 3 10 2 6 4 7 1 7 4 9 1 8 4 32 1 9 5 7 1 10 5 8 1 11 5 26 1 12 6 10 1 13 6 11 1 14 6 12 1 15 6 13 1 16 7 27 1 17 7 28 1 18 8 29 1 19 8 30 1 20 9 14 1 21 9 15 1 22 9 31 1 23 11 33 1 24 11 34 1 25 11 35 1 26 12 36 1 27 12 37 1 28 12 38 1 29 13 39 1 30 13 40 1 31 13 41 1 32 14 42 1 33 14 43 1 34 14 44 1 35 15 45 1 36 15 46 1 37 15 47 1 38 16 17 ar 39 16 19 ar 40 17 18 ar 41 17 20 ar 42 18 21 ar 43 18 23 ar 44 19 22 ar 45 19 48 1 46 20 24 ar 47 20 49 1 48 21 22 ar 49 21 50 1 50 22 51 1 51 23 25 ar 52 23 52 1 53 24 25 ar 54 24 53 1 55 25 54 1