@MOLECULE 1-amino-l-proline 19 19 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.0882 -1.2169 0.2078 O.3 1 UNL1111111111 -0.5561 2 O -2.1298 1.0067 0.0752 O.2 1 UNL1111111111 -0.5109 3 N 0.7443 0.7713 0.3469 N.3 1 UNL1111111111 -0.2805 4 N 0.7456 2.0656 -0.2891 N.3 1 UNL1111111111 -0.5073 5 C -0.0716 -0.1748 -0.4830 C.3 1 UNL1111111111 -0.0500 6 C 0.5438 -1.5595 -0.2231 C.3 1 UNL1111111111 -0.2630 7 C 2.0431 -1.2728 -0.0376 C.3 1 UNL1111111111 -0.2862 8 C 2.1343 0.2123 0.3733 C.3 1 UNL1111111111 -0.1221 9 C -1.5050 -0.0164 -0.0288 C.2 1 UNL1111111111 0.6326 10 H -0.0309 0.0699 -1.5808 H 1 UNL1111111111 0.1744 11 H 0.3440 -2.2594 -1.0484 H 1 UNL1111111111 0.1498 12 H 0.1150 -2.0234 0.6859 H 1 UNL1111111111 0.1669 13 H 2.4864 -1.9307 0.7263 H 1 UNL1111111111 0.1455 14 H 2.6016 -1.4579 -0.9701 H 1 UNL1111111111 0.1420 15 H 2.4910 0.3258 1.4179 H 1 UNL1111111111 0.1465 16 H 2.8323 0.7683 -0.2837 H 1 UNL1111111111 0.1448 17 H -0.2365 2.3592 -0.3406 H 1 UNL1111111111 0.2661 18 H 1.2079 2.7061 0.3577 H 1 UNL1111111111 0.2505 19 H -3.0320 -1.1460 0.4998 H 1 UNL1111111111 0.3569 @BOND 1 1 9 1 2 1 19 1 3 2 9 2 4 3 4 1 5 3 5 1 6 3 8 1 7 4 17 1 8 4 18 1 9 5 6 1 10 5 9 1 11 5 10 1 12 6 7 1 13 6 11 1 14 6 12 1 15 7 8 1 16 7 13 1 17 7 14 1 18 8 15 1 19 8 16 1