OpenBabel01152217133D 22 27 0 0 0 0 0 0 0 0999 V2000 -2.6288 0.3244 0.5223 O 0 0 2 0 0 0 0 0 0 0 0 0 -5.0470 1.6775 -0.2777 O 0 0 2 0 0 0 0 0 0 0 0 0 -3.9897 -0.3588 -1.8464 O 0 0 1 0 0 0 0 0 0 0 0 0 -5.5520 0.0310 -0.9005 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -3.2491 1.3580 -1.0802 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.5380 -1.1391 -0.2096 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -5.2314 -0.9979 0.6603 O 0 0 1 0 0 0 0 0 0 0 0 0 -4.4328 0.9175 1.7818 Ca 0 0 0 0 0 0 0 0 0 0 0 0 -5.4947 3.0387 -1.5551 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 2.4141 -2.5407 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0197 3.6050 -0.5187 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 4.3847 -2.8825 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8221 4.2211 -3.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6374 0.1260 3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7412 -0.2340 3.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7267 3.0849 1.6712 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8032 3.0615 2.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4544 0.9399 4.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9051 5.2391 -2.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6364 4.1725 0.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5416 3.5588 2.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0575 3.5178 -0.6076 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 6 0 0 0 1 6 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 6 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 5 1 1 0 0 0 3 6 1 0 0 0 0 4 3 1 0 0 0 0 5 10 1 6 0 0 0 7 4 1 6 0 0 0 7 6 1 0 0 0 0 7 8 1 0 0 0 0 8 1 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 20 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 M END $$$$ OpenBabel01152217133D 21 26 0 0 0 0 0 0 0 0999 V2000 -2.6288 0.3244 0.5223 O 0 0 2 0 0 0 0 0 0 0 0 0 -5.0470 1.6775 -0.2777 O 0 0 2 0 0 0 0 0 0 0 0 0 -3.9897 -0.3588 -1.8464 O 0 0 1 0 0 0 0 0 0 0 0 0 -5.5520 0.0310 -0.9005 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -3.2491 1.3580 -1.0802 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.5380 -1.1391 -0.2096 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -5.2314 -0.9979 0.6603 O 0 0 1 0 0 0 0 0 0 0 0 0 -4.4328 0.9175 1.7818 Ca 0 0 0 0 0 0 0 0 0 0 0 0 -5.4947 3.0387 -1.5551 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.9450 2.4141 -2.5407 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0197 3.6050 -0.5187 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 4.3847 -2.8825 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8221 4.2211 -3.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6374 0.1260 3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7412 -0.2340 3.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7267 3.0849 1.6712 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8032 3.0615 2.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4544 0.9399 4.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9051 5.2391 -2.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6364 4.1725 0.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5416 3.5588 2.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 6 0 0 0 1 6 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 6 0 0 0 2 8 1 0 0 0 0 3 5 1 1 0 0 0 3 6 1 0 0 0 0 4 3 1 0 0 0 0 5 10 1 6 0 0 0 7 4 1 6 0 0 0 7 6 1 0 0 0 0 7 8 1 0 0 0 0 8 1 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 9 2 1 6 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 M END $$$$ OpenBabel01152217143D 20 25 0 0 0 0 0 0 0 0999 V2000 -2.6288 0.3244 0.5223 O 0 0 2 0 0 0 0 0 0 0 0 0 -5.0470 1.6775 -0.2777 O 0 0 2 0 0 0 0 0 0 0 0 0 -3.9897 -0.3588 -1.8464 O 0 0 1 0 0 0 0 0 0 0 0 0 -5.5520 0.0310 -0.9005 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -3.2491 1.3580 -1.0802 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.5380 -1.1391 -0.2096 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -5.2314 -0.9979 0.6603 O 0 0 1 0 0 0 0 0 0 0 0 0 -4.4328 0.9175 1.7818 Ca 0 0 0 0 0 0 0 0 0 0 0 0 -5.4947 3.0387 -1.5551 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.9450 2.4141 -2.5407 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0197 3.6050 -0.5187 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 4.3847 -2.8825 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8221 4.2211 -3.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6374 0.1260 3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7412 -0.2340 3.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7267 3.0849 1.6712 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8032 3.0615 2.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4544 0.9399 4.3024 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9051 5.2391 -2.3822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6364 4.1725 0.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 6 0 0 0 1 6 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 6 0 0 0 2 8 1 0 0 0 0 3 5 1 1 0 0 0 3 6 1 0 0 0 0 4 3 1 0 0 0 0 5 10 1 6 0 0 0 7 4 1 6 0 0 0 7 6 1 0 0 0 0 7 8 1 0 0 0 0 8 1 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 9 2 1 6 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 M END $$$$ OpenBabel01152217143D 19 24 0 0 0 0 0 0 0 0999 V2000 -2.6725 0.3155 0.4998 O 0 0 2 0 0 0 0 0 0 0 0 0 -5.0565 1.7543 -0.2545 O 0 0 2 0 0 0 0 0 0 0 0 0 -4.1151 -0.3337 -1.8298 O 0 0 1 0 0 0 0 0 0 0 0 0 -5.6382 0.1229 -0.8503 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -3.2909 1.3594 -1.0968 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.6540 -1.1177 -0.1973 Mn 0 0 0 0 0 0 0 0 0 0 0 0 -5.3193 -0.9049 0.7115 O 0 0 1 0 0 0 0 0 0 0 0 0 -4.4213 0.9875 1.7963 Ca 0 0 0 0 0 0 0 0 0 0 0 0 -5.4808 3.1178 -1.5366 Mn 0 0 2 0 0 0 0 0 0 0 0 0 -3.9788 2.4297 -2.5516 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7202 3.6452 -0.6442 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8459 4.4658 -2.8738 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7921 4.3335 -3.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6089 0.1817 3.7708 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6909 -0.1205 3.5553 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6332 3.1242 1.6492 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7195 3.0759 2.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4793 0.9880 4.3309 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8306 5.3313 -2.3921 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 6 0 0 0 1 6 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 6 0 0 0 2 8 1 0 0 0 0 3 5 1 1 0 0 0 3 6 1 0 0 0 0 4 3 1 0 0 0 0 5 10 1 6 0 0 0 7 4 1 6 0 0 0 7 6 1 0 0 0 0 7 8 1 0 0 0 0 8 1 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 9 2 1 6 0 0 0 9 10 1 0 0 0 0 9 11 3 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 M END $$$$