./iterations/neb0_image05_iter15_CONTCAR output for 41: 3.3A-->1.3A (Job 121) O-H...N hydrogen bond by TSA-OH, TSA-NH2 (TSS)
Status: finishedNo title 1.00000000000000 15.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 12.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 12.0000000000000000 N Si O H 3 6 1 19 Direct 0.2801267400000000 0.4665559000000030 0.5209644899999972 0.7535701199999991 0.4864742000000035 0.5497719600000011 0.6014754500000024 0.4441060899999982 0.4166835999999989 0.3489564500000029 0.5813221299999967 0.5411823700000014 0.1649970200000013 0.4771979100000010 0.4967478599999993 0.3251556399999984 0.3314112500000022 0.5257783799999984 0.7140155499999992 0.4690847099999971 0.4135577699999970 0.8567082300000024 0.5476800100000006 0.5769009400000016 0.6890577200000010 0.4359502100000014 0.6602187000000015 0.4222027599999976 0.6006239100000030 0.4381965199999982 0.2903500199999982 0.6808180299999975 0.5545556499999975 0.4079945599999988 0.5622251200000008 0.6387614900000003 0.1407112500000025 0.5976686999999998 0.4939363700000001 0.1138028199999965 0.4198966599999991 0.5867212499999965 0.1406126400000005 0.4244273199999995 0.3881235699999976 0.3873640799999976 0.3106748499999981 0.4307582799999992 0.2492566299999979 0.2512704800000023 0.5180184900000029 0.3747169900000031 0.3135950400000027 0.6321023499999967 0.3988021999999987 0.6225524199999981 0.3659438399999999 0.7389919399999982 0.5718693800000025 0.3504154499999999 0.7550843400000034 0.3695594400000033 0.3589616599999985 0.9014673200000018 0.5704151500000023 0.4678838700000014 0.9150864200000015 0.4721580799999998 0.6438611000000023 0.8479442599999985 0.6550795400000027 0.6391729400000017 0.6057267799999977 0.5014439500000023 0.6785262499999973 0.7456253300000029 0.4467716899999985 0.7624925699999991 0.6648519100000030 0.3161578300000016 0.6453061400000024 0.5762599199999983 0.3724949499999965 0.3844297200000000 0.5535188599999969 0.5034834100000012 0.4264469700000006 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00