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Prediction _.& ?@p? MNova 02031017172D 1 0 0 0 0 0 0 0 0 0999 V2000 0.0000 100.0000 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 A 1 A M END B A?UU`SpinSplitTrans  SSGroupData ?əNumber? -SpinSimTrans & @&՚W?<Ƒ -ChemShift J-!@*p =?  Data File Name parameters /Title.Predicted NMR Spectrum Title FComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?n?y>t>?x*?>c?=}?v?- zO?-3T ?Qx= _>f{-?]rz"uBo={m}u>ia'/?6d?[ؾ|?u6r?:>IrH?{?(W?dV?/;>w?MZ2Vw?_kW?LF?Mpf>`z~1cnҾ&/23ƾ@ f ,d3z0t>3`m?MA2 Y?O4v?s?dQ>/P???zI?ہ> Zp?E(ɽӂw?߾^?7d'?Z g> xo ?BZJYL?.] Mp?`/t? >MX?P%>? 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Prediction _.& ?@p? MNova 02031017172D 1 0 0 0 0 0 0 0 0 0999 V2000 0.0000 100.0000 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 A 1 A M END B A?UU`SpinSplitTrans  SSGroupData ?əNumber? -SpinSimTrans & @J]+?<Ƒ -ChemShift J-!@Q?  Data File Name parameters /Title.Predicted NMR Spectrum Title DComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?s?>P?0??eIK?>^Tp?5=~?(֤u? |U?̻Dt!?r"lBݼ>q}S=wjΧY*uZ'=y];g?D߽e{pqE>E'x>]6?b5.b?&wݾ2y?`x?/ >a?>)4?/?h%>]?|8>w?8Gy?Ѿ/d?)m(u9?^Xc>Xtz[>PSyëg/d3? kR+_~Fq.C=Hy>i0,?ED;%M?޾ m?Tfx?C I?O??LG?~'>p8j?-`^$vq=V ooPQr- yR:acSt6gK>F3p>zxUߞ3?&v]?!}Ѿr?1q?bI'>X?p'>,?,?>X?&>Qp?4mq?Cо"+\?% O2?ߙS>rmSI>oqIk|_6G7+b8INHTk*jbm=~q>a?WA?bd? ?B?ʖ>l:d?<:o;=;gsI ǻ6q\ӌmP>*wh>ԱMF0?9#X? ž3Q?>+%?C)?>S?2f>i? ]i?}SϾdT?"A +?N>lJg8>6jIϽ`FWپVF0zvխI-(Yd-=&j;>jY?:5:_D? a?ڿyi? =\?!>W9?Cp ?f?>?>%Z^?a*i?ެ^? 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Prediction _.& ?@p? MNova 02031017172D 1 0 0 0 0 0 0 0 0 0999 V2000 0.0000 100.0000 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 A 1 A M END B A?UU`SpinSplitTrans  SSGroupData ?əNumber? -SpinSimTrans & @&՚W?<Ƒ -ChemShift J-!@*p =?  Data File Name parameters /Title.Predicted NMR Spectrum Title FComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?n?y>t>?x*?>c?=}?v?- zO?-3T ?Qx= _>f{-?]rz"uBo={m}u>ia'/?6d?[ؾ|?u6r?:>IrH?{?(W?dV?/;>w?MZ2Vw?_kW?LF?Mpf>`z~1cnҾ&/23ƾ@ f ,d3z0t>3`m?MA2 Y?O4v?s?dQ>/P???zI?ہ> Zp?E(ɽӂw?߾^?7d'?Z g> xo ?BZJYL?.] Mp?`/t? >MX?P%>? 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Data File Name parameters /Title.Predicted NMR Spectrum Title G*2Comment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 4096Spectral Size:parametersxmAK1&փuEivMfQo݊i|M&i3uKʭ.P<سd'٬|5m#5j,h1)J2TM p7pV9"K F8+]y|aO+앾*@kjx]' ~lwƊͩp[)bH.}_;Z=0HH< Oau?1 1D?j+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz?uj?)u>-?H;?o'>q?8~?a?FC?Guׄ>{_WQ, @(]ye^>w?L8Z?-X{{?r?>Zt@?#?> c?Jq-=9|?^k?1(10X3?i>{:bc5׾/W%P=:jpo=my<>7ZW`H?s?ugKv?.1>O? ??JR?>v?qxJq?eD?[˖> x=k38&̾|b BC8x>mdɅ3?s*h?ۿ w?pr=%<\?>*?~ ??P>m?t??R?DyI ?6q}F>pK(HWORe }s>Ǣk?~<Z?Kܾnt?t1XLe?v>0?)?>>ma?ŏ t?f$˾0]?5"?sBg˘>Wr^U]U~@0lkm >Vop;?eAKJJ?a5n?"%Rk?Zde>i@?ze?>R?@N=Ap?[e?C4?cZlO>ǣp6 Vw`7?JL.e?P8Mm?Y=M?>Z> ?A?K>k>IeL}̰8EھpRlӟ>W_c"?,Y?l?;L9X?ܰ>?#.?ާ>xR_?o>k?T޾O?O8?Bc:p>xh֦FB+fu;S>:dW ?tN<K?pZh?lν1o_?W>1??*T>R?v =Ai?UY?$$?XM>h  1Qpɾn/Ho]=f> I\:?w %a?vP vc?Vf)>q???3>/C? >&d?.k_?4?'KE->3te=Ye3[)"f&QAe>R@&?&W?LQd?v=J?>?ʅ1?s>\?;`a?97|B?;O ?HK_1>F^A>8$,/.؏CL޽Ka>wY?p-~J?0ɾb?1S?4>f!?N?rI>,Q? :Wa?~T#rL?B(E?C>V>6_qPD@۾ 2T.Zl>[ ]>(+;;?U\?߫X?jY>&1? q?Oi>5C?$=C^?틾5S?1&?|J}>^^<>vM5.8 ,V&PC=D]d>FWj*?w 2T?Lvj[?q==?pS>lQ?3?6>W?Mu1X?;4?5><>Z=pSo)p Ǿ#CUW[M>u N?$I?Z?+e?!!?>;N?#Õ+cY??Ͼ ??C+ ?R[X>]V= 6꾿`񾰟4bɥU{H> S0?2N-u"?*?U>:C?pV:AV #QLytMϤ=vUo>u99,? 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Data File Name parameters /Title.Predicted NMR Spectrum Title DComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?s?>P?0??eIK?>^Tp?5=~?(֤u? |U?̻Dt!?r"lBݼ>q}S=wjΧY*uZ'=y];g?D߽e{pqE>E'x>]6?b5.b?&wݾ2y?`x?/ >a?>)4?/?h%>]?|8>w?8Gy?Ѿ/d?)m(u9?^Xc>Xtz[>PSyëg/d3? kR+_~Fq.C=Hy>i0,?ED;%M?޾ m?Tfx?C I?O??LG?~'>p8j?-`^$vq=V ooPQr- yR:acSt6gK>F3p>zxUߞ3?&v]?!}Ѿr?1q?bI'>X?p'>,?,?>X?&>Qp?4mq?Cо"+\?% O2?ߙS>rmSI>oqIk|_6G7+b8INHTk*jbm=~q>a?WA?bd? ?B?ʖ>l:d?<:o;=;gsI ǻ6q\ӌmP>*wh>ԱMF0?9#X? ž3Q?>+%?C)?>S?2f>i? ]i?}SϾdT?"A +?N>lJg8>6jIϽ`FWپVF0zvխI-(Yd-=&j;>jY?:5:_D? a?ڿyi? =\?!>W9?Cp ?f?>?>%Z^?a*i?ެ^? 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Prediction _.& ?@p? MNova 02031017172D 1 0 0 0 0 0 0 0 0 0999 V2000 0.0000 100.0000 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 A 1 A M END B A?UU`SpinSplitTrans  SSGroupData ?əNumber? -SpinSimTrans & @&՚W?<Ƒ -ChemShift J-!@*p =?  Data File Name parameters /Title.Predicted NMR Spectrum Title FComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?n?y>t>?x*?>c?=}?v?- zO?-3T ?Qx= _>f{-?]rz"uBo={m}u>ia'/?6d?[ؾ|?u6r?:>IrH?{?(W?dV?/;>w?MZ2Vw?_kW?LF?Mpf>`z~1cnҾ&/23ƾ@ f ,d3z0t>3`m?MA2 Y?O4v?s?dQ>/P???zI?ہ> Zp?E(ɽӂw?߾^?7d'?Z g> xo ?BZJYL?.] Mp?`/t? >MX?P%>? 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Data File Name parameters /Title.Predicted NMR Spectrum Title G*2Comment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 4096Spectral Size:parametersxmAK1&փuEivMfQo݊i|M&i3uKʭ.P<سd'٬|5m#5j,h1)J2TM p7pV9"K F8+]y|aO+앾*@kjx]' ~lwƊͩp[)bH.}_;Z=0HH< Oau?1 1D?j+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz?uj?)u>-?H;?o'>q?8~?a?FC?Guׄ>{_WQ, @(]ye^>w?L8Z?-X{{?r?>Zt@?#?> c?Jq-=9|?^k?1(10X3?i>{:bc5׾/W%P=:jpo=my<>7ZW`H?s?ugKv?.1>O? ??JR?>v?qxJq?eD?[˖> x=k38&̾|b BC8x>mdɅ3?s*h?ۿ w?pr=%<\?>*?~ ??P>m?t??R?DyI ?6q}F>pK(HWORe }s>Ǣk?~<Z?Kܾnt?t1XLe?v>0?)?>>ma?ŏ t?f$˾0]?5"?sBg˘>Wr^U]U~@0lkm >Vop;?eAKJJ?a5n?"%Rk?Zde>i@?ze?>R?@N=Ap?[e?C4?cZlO>ǣp6 Vw`7?JL.e?P8Mm?Y=M?>Z> ?A?K>k>IeL}̰8EھpRlӟ>W_c"?,Y?l?;L9X?ܰ>?#.?ާ>xR_?o>k?T޾O?O8?Bc:p>xh֦FB+fu;S>:dW ?tN<K?pZh?lν1o_?W>1??*T>R?v =Ai?UY?$$?XM>h  1Qpɾn/Ho]=f> I\:?w %a?vP vc?Vf)>q???3>/C? >&d?.k_?4?'KE->3te=Ye3[)"f&QAe>R@&?&W?LQd?v=J?>?ʅ1?s>\?;`a?97|B?;O ?HK_1>F^A>8$,/.؏CL޽Ka>wY?p-~J?0ɾb?1S?4>f!?N?rI>,Q? :Wa?~T#rL?B(E?C>V>6_qPD@۾ 2T.Zl>[ ]>(+;;?U\?߫X?jY>&1? q?Oi>5C?$=C^?틾5S?1&?|J}>^^<>vM5.8 ,V&PC=D]d>FWj*?w 2T?Lvj[?q==?pS>lQ?3?6>W?Mu1X?;4?5><>Z=pSo)p Ǿ#CUW[M>u N?$I?Z?+e?!!?>;N?#Õ+cY??Ͼ ??C+ ?R[X>]V= 6꾿`񾰟4bɥU{H> S0?2N-u"?*?U>:C?pV:AV #QLytMϤ=vUo>u99,? 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Prediction _.& ?@p? MNova 02031017172D 1 0 0 0 0 0 0 0 0 0999 V2000 0.0000 100.0000 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 A 1 A M END B A?UU`SpinSplitTrans  SSGroupData ?əNumber? -SpinSimTrans & @&՚W?<Ƒ -ChemShift J-!@*p =?  Data File Name parameters /Title.Predicted NMR Spectrum Title FComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?n?y>t>?x*?>c?=}?v?- zO?-3T ?Qx= _>f{-?]rz"uBo={m}u>ia'/?6d?[ؾ|?u6r?:>IrH?{?(W?dV?/;>w?MZ2Vw?_kW?LF?Mpf>`z~1cnҾ&/23ƾ@ f ,d3z0t>3`m?MA2 Y?O4v?s?dQ>/P???zI?ہ> Zp?E(ɽӂw?߾^?7d'?Z g> xo ?BZJYL?.] Mp?`/t? >MX?P%>? 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Prediction _.& ?@p? MNova 02031017172D 1 0 0 0 0 0 0 0 0 0999 V2000 0.0000 100.0000 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 A 1 A M END B A?UU`SpinSplitTrans  SSGroupData ?əNumber? -SpinSimTrans & @J]+?<Ƒ -ChemShift J-!@Q?  Data File Name parameters /Title.Predicted NMR Spectrum Title DComment parameters /Name Origin  Owner Site Spectrometer  Author parameters/SolventSolvent Temperature Pulse Sequence 1DExperiment Number of Scans Receiver Gain  Relaxation Delay Pulse Width  Acquisition Time  Acquisition Date "Modification Date parameters/VersionVersion parameters6/Options/Settings/AlgorithmAlgorithm parametersH/Options/Settings/Algorithm.useincdb Use DB parametersL/Options/Settings/Algorithm.gmmxcyclesGMMX Cycles parameters/LineWidth0.5Line Width 1,Spectrometer Frequency 3000Spectral Width 0 Lowest Frequency Nucleus Acquired Size 2048Spectral Size:parametersxmN1 D|~ P$Q.P-+Z9Z&i [qٴ:%ePYcv\zI]lO@`5Af%{&M8+FU~MJ GzᮼZ}~mO+^`H5G5<Ȯ[;acETRt81B$ᆵܞq~$:iyυ 1D?Bj+ CDz CDz CDz CDz CDz CDz CDz@ CDz ?E; CDz CDz CDz CDz CDz@@@?s?>P?0??eIK?>^Tp?5=~?(֤u? |U?̻Dt!?r"lBݼ>q}S=wjΧY*uZ'=y];g?D߽e{pqE>E'x>]6?b5.b?&wݾ2y?`x?/ >a?>)4?/?h%>]?|8>w?8Gy?Ѿ/d?)m(u9?^Xc>Xtz[>PSyëg/d3? kR+_~Fq.C=Hy>i0,?ED;%M?޾ m?Tfx?C I?O??LG?~'>p8j?-`^$vq=V ooPQr- yR:acSt6gK>F3p>zxUߞ3?&v]?!}Ѿr?1q?bI'>X?p'>,?,?>X?&>Qp?4mq?Cо"+\?% O2?ߙS>rmSI>oqIk|_6G7+b8INHTk*jbm=~q>a?WA?bd? ?B?ʖ>l:d?<:o;=;gsI ǻ6q\ӌmP>*wh>ԱMF0?9#X? ž3Q?>+%?C)?>S?2f>i? ]i?}SϾdT?"A +?N>lJg8>6jIϽ`FWپVF0zvխI-(Yd-=&j;>jY?:5:_D? a?ڿyi? =\?!>W9?Cp ?f?>?>%Z^?a*i?ެ^? 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