0 mol 54 unq 0 iso 0 dist 6.59893 11.9881 9.5589 10.3564 6.83299 5.08001 12.4254 8.10861 16.3192 14.2075 10.8658 5.02241 6.91765 5.06052 10.1332 numMergedOcc 0
1 mol 54 unq 0 iso 1 dist 6.59893 11.9881 9.5589 12.4254 8.10861 16.3192 10.3564 6.83299 5.08001 14.2075 10.8658 5.02241 6.91765 10.1332 5.06052 numMergedOcc 0
2 mol 54 unq 0 iso 2 dist 6.59893 10.3564 6.83299 11.9881 9.5589 5.08001 12.4254 8.10861 14.2075 16.3192 10.8658 5.02241 5.06052 6.91765 10.1332 numMergedOcc 0
3 mol 54 unq 0 iso 3 dist 6.59893 10.3564 6.83299 12.4254 8.10861 14.2075 11.9881 9.5589 5.08001 16.3192 10.8658 5.02241 5.06052 10.1332 6.91765 numMergedOcc 0
4 mol 54 unq 0 iso 4 dist 6.59893 12.4254 8.10861 11.9881 9.5589 16.3192 10.3564 6.83299 14.2075 5.08001 10.8658 5.02241 10.1332 6.91765 5.06052 numMergedOcc 0
5 mol 54 unq 0 iso 5 dist 6.59893 12.4254 8.10861 10.3564 6.83299 14.2075 11.9881 9.5589 16.3192 5.08001 10.8658 5.02241 10.1332 5.06052 6.91765 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 5.59773 13.9079 9.5589 10.4238 6.83299 5.08001 10.1356 8.10861 16.3192 14.2075 10.352 5.02241 6.91765 5.06052 10.1332 numMergedOcc 0
7 mol 54 unq 1 iso 1 dist 5.59773 13.9079 9.5589 10.1356 8.10861 16.3192 10.4238 6.83299 5.08001 14.2075 10.352 5.02241 6.91765 10.1332 5.06052 numMergedOcc 0
8 mol 54 unq 1 iso 2 dist 5.59773 10.4238 6.83299 13.9079 9.5589 5.08001 10.1356 8.10861 14.2075 16.3192 10.352 5.02241 5.06052 6.91765 10.1332 numMergedOcc 0
9 mol 54 unq 1 iso 3 dist 5.59773 10.4238 6.83299 10.1356 8.10861 14.2075 13.9079 9.5589 5.08001 16.3192 10.352 5.02241 5.06052 10.1332 6.91765 numMergedOcc 0
10 mol 54 unq 1 iso 4 dist 5.59773 10.1356 8.10861 13.9079 9.5589 16.3192 10.4238 6.83299 14.2075 5.08001 10.352 5.02241 10.1332 6.91765 5.06052 numMergedOcc 0
11 mol 54 unq 1 iso 5 dist 5.59773 10.1356 8.10861 10.4238 6.83299 14.2075 13.9079 9.5589 16.3192 5.08001 10.352 5.02241 10.1332 5.06052 6.91765 numMergedOcc 0
12 mol 142 unq 0 iso 0 dist 7.57458 13.1936 9.2313 12.288 7.73169 5.50998 14.2067 8.96657 11.1395 5.92693 5.81429 7.15475 9.49653 7.53854 10.3477 numMergedOcc 0
13 mol 142 unq 0 iso 1 dist 7.57458 13.1936 9.2313 14.2067 8.96657 11.1395 12.288 7.73169 5.50998 5.92693 5.81429 7.15475 9.49653 10.3477 7.53854 numMergedOcc 0
14 mol 142 unq 0 iso 2 dist 7.57458 12.288 7.73169 13.1936 9.2313 5.50998 14.2067 8.96657 5.92693 11.1395 5.81429 7.15475 7.53854 9.49653 10.3477 numMergedOcc 0
15 mol 142 unq 0 iso 3 dist 7.57458 12.288 7.73169 14.2067 8.96657 5.92693 13.1936 9.2313 5.50998 11.1395 5.81429 7.15475 7.53854 10.3477 9.49653 numMergedOcc 0
16 mol 142 unq 0 iso 4 dist 7.57458 14.2067 8.96657 13.1936 9.2313 11.1395 12.288 7.73169 5.92693 5.50998 5.81429 7.15475 10.3477 9.49653 7.53854 numMergedOcc 0
17 mol 142 unq 0 iso 5 dist 7.57458 14.2067 8.96657 12.288 7.73169 5.92693 13.1936 9.2313 11.1395 5.50998 5.81429 7.15475 10.3477 7.53854 9.49653 numMergedOcc 0
18 mol 152 unq 0 iso 0 dist 9.10619 9.66339 8.56324 13.9994 6.70283 7.65448 14.2552 7.16148 10.6875 5.49936 10.5988 9.13561 5.99333 8.25411 7.89109 numMergedOcc 0
19 mol 152 unq 0 iso 1 dist 9.10619 9.66339 8.56324 14.2552 7.16148 10.6875 13.9994 6.70283 7.65448 5.49936 10.5988 9.13561 5.99333 7.89109 8.25411 numMergedOcc 0
20 mol 152 unq 0 iso 2 dist 9.10619 13.9994 6.70283 9.66339 8.56324 7.65448 14.2552 7.16148 5.49936 10.6875 10.5988 9.13561 8.25411 5.99333 7.89109 numMergedOcc 0
21 mol 152 unq 0 iso 3 dist 9.10619 13.9994 6.70283 14.2552 7.16148 5.49936 9.66339 8.56324 7.65448 10.6875 10.5988 9.13561 8.25411 7.89109 5.99333 numMergedOcc 0
22 mol 152 unq 0 iso 4 dist 9.10619 14.2552 7.16148 9.66339 8.56324 10.6875 13.9994 6.70283 5.49936 7.65448 10.5988 9.13561 7.89109 5.99333 8.25411 numMergedOcc 0
23 mol 152 unq 0 iso 5 dist 9.10619 14.2552 7.16148 13.9994 6.70283 5.49936 9.66339 8.56324 10.6875 7.65448 10.5988 9.13561 7.89109 8.25411 5.99333 numMergedOcc 0
24 mol 156 unq 0 iso 0 dist 7.30021 5.0966 7.44554 5.75141 8.94056 5.56175 12.865 9.83699 8.38403 11.2719 10.3893 6.27641 7.29758 8.67156 4.53931 numMergedOcc 0
25 mol 156 unq 0 iso 1 dist 7.30021 5.0966 7.44554 12.865 9.83699 8.38403 5.75141 8.94056 5.56175 11.2719 10.3893 6.27641 7.29758 4.53931 8.67156 numMergedOcc 0
26 mol 156 unq 0 iso 2 dist 7.30021 5.75141 8.94056 5.0966 7.44554 5.56175 12.865 9.83699 11.2719 8.38403 10.3893 6.27641 8.67156 7.29758 4.53931 numMergedOcc 0
27 mol 156 unq 0 iso 3 dist 7.30021 5.75141 8.94056 12.865 9.83699 11.2719 5.0966 7.44554 5.56175 8.38403 10.3893 6.27641 8.67156 4.53931 7.29758 numMergedOcc 0
28 mol 156 unq 0 iso 4 dist 7.30021 12.865 9.83699 5.0966 7.44554 8.38403 5.75141 8.94056 11.2719 5.56175 10.3893 6.27641 4.53931 7.29758 8.67156 numMergedOcc 0
29 mol 156 unq 0 iso 5 dist 7.30021 12.865 9.83699 5.75141 8.94056 11.2719 5.0966 7.44554 8.38403 5.56175 10.3893 6.27641 4.53931 8.67156 7.29758 numMergedOcc 0
30 mol 175 unq 0 iso 0 dist 8.69888 11.5099 9.0018 5.50014 5.6234 6.2715 7.39186 6.57069 8.16421 5.35493 14.6255 9.8589 8.22779 10.5631 7.5414 numMergedOcc 0
31 mol 175 unq 0 iso 1 dist 8.69888 11.5099 9.0018 7.39186 6.57069 8.16421 5.50014 5.6234 6.2715 5.35493 14.6255 9.8589 8.22779 7.5414 10.5631 numMergedOcc 0
32 mol 175 unq 0 iso 2 dist 8.69888 5.50014 5.6234 11.5099 9.0018 6.2715 7.39186 6.57069 5.35493 8.16421 14.6255 9.8589 10.5631 8.22779 7.5414 numMergedOcc 0
33 mol 175 unq 0 iso 3 dist 8.69888 5.50014 5.6234 7.39186 6.57069 5.35493 11.5099 9.0018 6.2715 8.16421 14.6255 9.8589 10.5631 7.5414 8.22779 numMergedOcc 0
34 mol 175 unq 0 iso 4 dist 8.69888 7.39186 6.57069 11.5099 9.0018 8.16421 5.50014 5.6234 5.35493 6.2715 14.6255 9.8589 7.5414 8.22779 10.5631 numMergedOcc 0
35 mol 175 unq 0 iso 5 dist 8.69888 7.39186 6.57069 5.50014 5.6234 5.35493 11.5099 9.0018 8.16421 6.2715 14.6255 9.8589 7.5414 10.5631 8.22779 numMergedOcc 0
36 mol 175 unq 1 iso 0 dist 5.08206 12.1783 9.0018 7.28617 5.6234 6.2715 5.77256 6.57069 8.16421 5.35493 11.5085 9.8589 8.22779 10.5631 7.5414 numMergedOcc 0
37 mol 175 unq 1 iso 1 dist 5.08206 12.1783 9.0018 5.77256 6.57069 8.16421 7.28617 5.6234 6.2715 5.35493 11.5085 9.8589 8.22779 7.5414 10.5631 numMergedOcc 0
38 mol 175 unq 1 iso 2 dist 5.08206 7.28617 5.6234 12.1783 9.0018 6.2715 5.77256 6.57069 5.35493 8.16421 11.5085 9.8589 10.5631 8.22779 7.5414 numMergedOcc 0
39 mol 175 unq 1 iso 3 dist 5.08206 7.28617 5.6234 5.77256 6.57069 5.35493 12.1783 9.0018 6.2715 8.16421 11.5085 9.8589 10.5631 7.5414 8.22779 numMergedOcc 0
40 mol 175 unq 1 iso 4 dist 5.08206 5.77256 6.57069 12.1783 9.0018 8.16421 7.28617 5.6234 5.35493 6.2715 11.5085 9.8589 7.5414 8.22779 10.5631 numMergedOcc 0
41 mol 175 unq 1 iso 5 dist 5.08206 5.77256 6.57069 7.28617 5.6234 5.35493 12.1783 9.0018 8.16421 6.2715 11.5085 9.8589 7.5414 10.5631 8.22779 numMergedOcc 0
42 mol 178 unq 0 iso 0 dist 8.0974 12.2822 6.69288 12.4338 6.43573 5.34677 13.9722 7.17202 11.7381 9.89739 11.6559 8.96511 10.5783 5.96647 12.075 numMergedOcc 0
43 mol 178 unq 0 iso 1 dist 8.0974 12.2822 6.69288 13.9722 7.17202 11.7381 12.4338 6.43573 5.34677 9.89739 11.6559 8.96511 10.5783 12.075 5.96647 numMergedOcc 0
44 mol 178 unq 0 iso 2 dist 8.0974 12.4338 6.43573 12.2822 6.69288 5.34677 13.9722 7.17202 9.89739 11.7381 11.6559 8.96511 5.96647 10.5783 12.075 numMergedOcc 0
45 mol 178 unq 0 iso 3 dist 8.0974 12.4338 6.43573 13.9722 7.17202 9.89739 12.2822 6.69288 5.34677 11.7381 11.6559 8.96511 5.96647 12.075 10.5783 numMergedOcc 0
46 mol 178 unq 0 iso 4 dist 8.0974 13.9722 7.17202 12.2822 6.69288 11.7381 12.4338 6.43573 9.89739 5.34677 11.6559 8.96511 12.075 10.5783 5.96647 numMergedOcc 0
47 mol 178 unq 0 iso 5 dist 8.0974 13.9722 7.17202 12.4338 6.43573 9.89739 12.2822 6.69288 11.7381 5.34677 11.6559 8.96511 12.075 5.96647 10.5783 numMergedOcc 0
48 mol 178 unq 1 iso 0 dist 8.0974 12.2822 6.69288 12.4338 6.43573 5.34677 13.5599 8.81551 14.0703 10.5529 11.6559 8.96511 10.5783 5.96647 9.92132 numMergedOcc 0
49 mol 178 unq 1 iso 1 dist 8.0974 12.2822 6.69288 13.5599 8.81551 14.0703 12.4338 6.43573 5.34677 10.5529 11.6559 8.96511 10.5783 9.92132 5.96647 numMergedOcc 0
50 mol 178 unq 1 iso 2 dist 8.0974 12.4338 6.43573 12.2822 6.69288 5.34677 13.5599 8.81551 10.5529 14.0703 11.6559 8.96511 5.96647 10.5783 9.92132 numMergedOcc 0
51 mol 178 unq 1 iso 3 dist 8.0974 12.4338 6.43573 13.5599 8.81551 10.5529 12.2822 6.69288 5.34677 14.0703 11.6559 8.96511 5.96647 9.92132 10.5783 numMergedOcc 0
52 mol 178 unq 1 iso 4 dist 8.0974 13.5599 8.81551 12.2822 6.69288 14.0703 12.4338 6.43573 10.5529 5.34677 11.6559 8.96511 9.92132 10.5783 5.96647 numMergedOcc 0
53 mol 178 unq 1 iso 5 dist 8.0974 13.5599 8.81551 12.4338 6.43573 10.5529 12.2822 6.69288 14.0703 5.34677 11.6559 8.96511 9.92132 5.96647 10.5783 numMergedOcc 0
54 mol 178 unq 1 iso 0 dist 8.0974 12.2822 6.69288 13.9722 7.17202 11.7381 13.5599 8.81551 14.0703 5.18005 11.6559 8.96511 10.5783 12.075 9.92132 numMergedOcc 0
55 mol 178 unq 1 iso 1 dist 8.0974 12.2822 6.69288 13.5599 8.81551 14.0703 13.9722 7.17202 11.7381 5.18005 11.6559 8.96511 10.5783 9.92132 12.075 numMergedOcc 0
56 mol 178 unq 1 iso 2 dist 8.0974 13.9722 7.17202 12.2822 6.69288 11.7381 13.5599 8.81551 5.18005 14.0703 11.6559 8.96511 12.075 10.5783 9.92132 numMergedOcc 0
57 mol 178 unq 1 iso 3 dist 8.0974 13.9722 7.17202 13.5599 8.81551 5.18005 12.2822 6.69288 11.7381 14.0703 11.6559 8.96511 12.075 9.92132 10.5783 numMergedOcc 0
58 mol 178 unq 1 iso 4 dist 8.0974 13.5599 8.81551 12.2822 6.69288 14.0703 13.9722 7.17202 5.18005 11.7381 11.6559 8.96511 9.92132 10.5783 12.075 numMergedOcc 0
59 mol 178 unq 1 iso 5 dist 8.0974 13.5599 8.81551 13.9722 7.17202 5.18005 12.2822 6.69288 14.0703 11.7381 11.6559 8.96511 9.92132 12.075 10.5783 numMergedOcc 0
60 mol 178 unq 1 iso 0 dist 8.0974 12.4338 6.43573 13.9722 7.17202 9.89739 13.5599 8.81551 10.5529 5.18005 11.6559 8.96511 5.96647 12.075 9.92132 numMergedOcc 0
61 mol 178 unq 1 iso 1 dist 8.0974 12.4338 6.43573 13.5599 8.81551 10.5529 13.9722 7.17202 9.89739 5.18005 11.6559 8.96511 5.96647 9.92132 12.075 numMergedOcc 0
62 mol 178 unq 1 iso 2 dist 8.0974 13.9722 7.17202 12.4338 6.43573 9.89739 13.5599 8.81551 5.18005 10.5529 11.6559 8.96511 12.075 5.96647 9.92132 numMergedOcc 0
63 mol 178 unq 1 iso 3 dist 8.0974 13.9722 7.17202 13.5599 8.81551 5.18005 12.4338 6.43573 9.89739 10.5529 11.6559 8.96511 12.075 9.92132 5.96647 numMergedOcc 0
64 mol 178 unq 1 iso 4 dist 8.0974 13.5599 8.81551 12.4338 6.43573 10.5529 13.9722 7.17202 5.18005 9.89739 11.6559 8.96511 9.92132 5.96647 12.075 numMergedOcc 0
65 mol 178 unq 1 iso 5 dist 8.0974 13.5599 8.81551 13.9722 7.17202 5.18005 12.4338 6.43573 10.5529 9.89739 11.6559 8.96511 9.92132 12.075 5.96647 numMergedOcc 0
66 mol 214 unq 0 iso 0 dist 8.49704 12.4611 9.65138 11.832 7.14453 9.10746 10.644 8.85478 4.40923 11.3796 13.4309 6.97182 6.16485 5.33565 8.47007 numMergedOcc 0
67 mol 214 unq 0 iso 1 dist 8.49704 12.4611 9.65138 10.644 8.85478 4.40923 11.832 7.14453 9.10746 11.3796 13.4309 6.97182 6.16485 8.47007 5.33565 numMergedOcc 0
68 mol 214 unq 0 iso 2 dist 8.49704 11.832 7.14453 12.4611 9.65138 9.10746 10.644 8.85478 11.3796 4.40923 13.4309 6.97182 5.33565 6.16485 8.47007 numMergedOcc 0
69 mol 214 unq 0 iso 3 dist 8.49704 11.832 7.14453 10.644 8.85478 11.3796 12.4611 9.65138 9.10746 4.40923 13.4309 6.97182 5.33565 8.47007 6.16485 numMergedOcc 0
70 mol 214 unq 0 iso 4 dist 8.49704 10.644 8.85478 12.4611 9.65138 4.40923 11.832 7.14453 11.3796 9.10746 13.4309 6.97182 8.47007 6.16485 5.33565 numMergedOcc 0
71 mol 214 unq 0 iso 5 dist 8.49704 10.644 8.85478 11.832 7.14453 11.3796 12.4611 9.65138 4.40923 9.10746 13.4309 6.97182 8.47007 5.33565 6.16485 numMergedOcc 0
72 mol 214 unq 1 iso 0 dist 8.49704 12.4611 9.65138 11.832 7.14453 9.10746 10.644 8.85478 4.40923 11.3796 13.5787 6.1175 11.5712 5.06792 12.8334 numMergedOcc 0
73 mol 214 unq 1 iso 1 dist 8.49704 12.4611 9.65138 10.644 8.85478 4.40923 11.832 7.14453 9.10746 11.3796 13.5787 6.1175 11.5712 12.8334 5.06792 numMergedOcc 0
74 mol 214 unq 1 iso 2 dist 8.49704 11.832 7.14453 12.4611 9.65138 9.10746 10.644 8.85478 11.3796 4.40923 13.5787 6.1175 5.06792 11.5712 12.8334 numMergedOcc 0
75 mol 214 unq 1 iso 3 dist 8.49704 11.832 7.14453 10.644 8.85478 11.3796 12.4611 9.65138 9.10746 4.40923 13.5787 6.1175 5.06792 12.8334 11.5712 numMergedOcc 0
76 mol 214 unq 1 iso 4 dist 8.49704 10.644 8.85478 12.4611 9.65138 4.40923 11.832 7.14453 11.3796 9.10746 13.5787 6.1175 12.8334 11.5712 5.06792 numMergedOcc 0
77 mol 214 unq 1 iso 5 dist 8.49704 10.644 8.85478 11.832 7.14453 11.3796 12.4611 9.65138 4.40923 9.10746 13.5787 6.1175 12.8334 5.06792 11.5712 numMergedOcc 0
78 mol 224 unq 0 iso 0 dist 9.33771 5.41021 8.95269 4.91322 6.57273 4.70378 12.979 5.78342 11.5372 8.49799 11.498 6.87664 7.98696 7.12232 5.3621 numMergedOcc 0
79 mol 224 unq 0 iso 1 dist 9.33771 5.41021 8.95269 12.979 5.78342 11.5372 4.91322 6.57273 4.70378 8.49799 11.498 6.87664 7.98696 5.3621 7.12232 numMergedOcc 0
80 mol 224 unq 0 iso 2 dist 9.33771 4.91322 6.57273 5.41021 8.95269 4.70378 12.979 5.78342 8.49799 11.5372 11.498 6.87664 7.12232 7.98696 5.3621 numMergedOcc 0
81 mol 224 unq 0 iso 3 dist 9.33771 4.91322 6.57273 12.979 5.78342 8.49799 5.41021 8.95269 4.70378 11.5372 11.498 6.87664 7.12232 5.3621 7.98696 numMergedOcc 0
82 mol 224 unq 0 iso 4 dist 9.33771 12.979 5.78342 5.41021 8.95269 11.5372 4.91322 6.57273 8.49799 4.70378 11.498 6.87664 5.3621 7.98696 7.12232 numMergedOcc 0
83 mol 224 unq 0 iso 5 dist 9.33771 12.979 5.78342 4.91322 6.57273 8.49799 5.41021 8.95269 11.5372 4.70378 11.498 6.87664 5.3621 7.12232 7.98696 numMergedOcc 0
84 mol 248 unq 0 iso 0 dist 8.71859 4.53213 7.69895 6.33032 7.21521 5.55137 11.762 8.2965 10.8081 5.86196 4.11367 6.07192 6.48757 5.51827 9.29921 numMergedOcc 0
85 mol 248 unq 0 iso 1 dist 8.71859 4.53213 7.69895 11.762 8.2965 10.8081 6.33032 7.21521 5.55137 5.86196 4.11367 6.07192 6.48757 9.29921 5.51827 numMergedOcc 0
86 mol 248 unq 0 iso 2 dist 8.71859 6.33032 7.21521 4.53213 7.69895 5.55137 11.762 8.2965 5.86196 10.8081 4.11367 6.07192 5.51827 6.48757 9.29921 numMergedOcc 0
87 mol 248 unq 0 iso 3 dist 8.71859 6.33032 7.21521 11.762 8.2965 5.86196 4.53213 7.69895 5.55137 10.8081 4.11367 6.07192 5.51827 9.29921 6.48757 numMergedOcc 0
88 mol 248 unq 0 iso 4 dist 8.71859 11.762 8.2965 4.53213 7.69895 10.8081 6.33032 7.21521 5.86196 5.55137 4.11367 6.07192 9.29921 6.48757 5.51827 numMergedOcc 0
89 mol 248 unq 0 iso 5 dist 8.71859 11.762 8.2965 6.33032 7.21521 5.86196 4.53213 7.69895 10.8081 5.55137 4.11367 6.07192 9.29921 5.51827 6.48757 numMergedOcc 0
90 mol 259 unq 0 iso 0 dist 9.58006 5.71237 7.88519 9.10984 7.84554 4.86771 11.8501 7.46176 6.96053 7.64658 15.1483 7.48005 11.6195 11.8736 5.79468 numMergedOcc 0
91 mol 259 unq 0 iso 1 dist 9.58006 5.71237 7.88519 11.8501 7.46176 6.96053 9.10984 7.84554 4.86771 7.64658 15.1483 7.48005 11.6195 5.79468 11.8736 numMergedOcc 0
92 mol 259 unq 0 iso 2 dist 9.58006 9.10984 7.84554 5.71237 7.88519 4.86771 11.8501 7.46176 7.64658 6.96053 15.1483 7.48005 11.8736 11.6195 5.79468 numMergedOcc 0
93 mol 259 unq 0 iso 3 dist 9.58006 9.10984 7.84554 11.8501 7.46176 7.64658 5.71237 7.88519 4.86771 6.96053 15.1483 7.48005 11.8736 5.79468 11.6195 numMergedOcc 0
94 mol 259 unq 0 iso 4 dist 9.58006 11.8501 7.46176 5.71237 7.88519 6.96053 9.10984 7.84554 7.64658 4.86771 15.1483 7.48005 5.79468 11.6195 11.8736 numMergedOcc 0
95 mol 259 unq 0 iso 5 dist 9.58006 11.8501 7.46176 9.10984 7.84554 7.64658 5.71237 7.88519 6.96053 4.86771 15.1483 7.48005 5.79468 11.8736 11.6195 numMergedOcc 0
96 mol 259 unq 1 iso 0 dist 9.58006 5.71237 7.88519 9.10984 7.84554 4.86771 13.9868 9.18903 10.4881 5.87173 15.1483 7.48005 11.6195 11.8736 12.6649 numMergedOcc 0
97 mol 259 unq 1 iso 1 dist 9.58006 5.71237 7.88519 13.9868 9.18903 10.4881 9.10984 7.84554 4.86771 5.87173 15.1483 7.48005 11.6195 12.6649 11.8736 numMergedOcc 0
98 mol 259 unq 1 iso 2 dist 9.58006 9.10984 7.84554 5.71237 7.88519 4.86771 13.9868 9.18903 5.87173 10.4881 15.1483 7.48005 11.8736 11.6195 12.6649 numMergedOcc 0
99 mol 259 unq 1 iso 3 dist 9.58006 9.10984 7.84554 13.9868 9.18903 5.87173 5.71237 7.88519 4.86771 10.4881 15.1483 7.48005 11.8736 12.6649 11.6195 numMergedOcc 0
100 mol 259 unq 1 iso 4 dist 9.58006 13.9868 9.18903 5.71237 7.88519 10.4881 9.10984 7.84554 5.87173 4.86771 15.1483 7.48005 12.6649 11.6195 11.8736 numMergedOcc 0
101 mol 259 unq 1 iso 5 dist 9.58006 13.9868 9.18903 9.10984 7.84554 5.87173 5.71237 7.88519 10.4881 4.86771 15.1483 7.48005 12.6649 11.8736 11.6195 numMergedOcc 0
102 mol 259 unq 1 iso 0 dist 9.58006 5.71237 7.88519 11.8501 7.46176 6.96053 13.9868 9.18903 10.4881 10.5239 15.1483 7.48005 11.6195 5.79468 12.6649 numMergedOcc 0
103 mol 259 unq 1 iso 1 dist 9.58006 5.71237 7.88519 13.9868 9.18903 10.4881 11.8501 7.46176 6.96053 10.5239 15.1483 7.48005 11.6195 12.6649 5.79468 numMergedOcc 0
104 mol 259 unq 1 iso 2 dist 9.58006 11.8501 7.46176 5.71237 7.88519 6.96053 13.9868 9.18903 10.5239 10.4881 15.1483 7.48005 5.79468 11.6195 12.6649 numMergedOcc 0
105 mol 259 unq 1 iso 3 dist 9.58006 11.8501 7.46176 13.9868 9.18903 10.5239 5.71237 7.88519 6.96053 10.4881 15.1483 7.48005 5.79468 12.6649 11.6195 numMergedOcc 0
106 mol 259 unq 1 iso 4 dist 9.58006 13.9868 9.18903 5.71237 7.88519 10.4881 11.8501 7.46176 10.5239 6.96053 15.1483 7.48005 12.6649 11.6195 5.79468 numMergedOcc 0
107 mol 259 unq 1 iso 5 dist 9.58006 13.9868 9.18903 11.8501 7.46176 10.5239 5.71237 7.88519 10.4881 6.96053 15.1483 7.48005 12.6649 5.79468 11.6195 numMergedOcc 0
108 mol 259 unq 1 iso 0 dist 9.58006 9.10984 7.84554 11.8501 7.46176 7.64658 13.9868 9.18903 5.87173 10.5239 15.1483 7.48005 11.8736 5.79468 12.6649 numMergedOcc 0
109 mol 259 unq 1 iso 1 dist 9.58006 9.10984 7.84554 13.9868 9.18903 5.87173 11.8501 7.46176 7.64658 10.5239 15.1483 7.48005 11.8736 12.6649 5.79468 numMergedOcc 0
110 mol 259 unq 1 iso 2 dist 9.58006 11.8501 7.46176 9.10984 7.84554 7.64658 13.9868 9.18903 10.5239 5.87173 15.1483 7.48005 5.79468 11.8736 12.6649 numMergedOcc 0
111 mol 259 unq 1 iso 3 dist 9.58006 11.8501 7.46176 13.9868 9.18903 10.5239 9.10984 7.84554 7.64658 5.87173 15.1483 7.48005 5.79468 12.6649 11.8736 numMergedOcc 0
112 mol 259 unq 1 iso 4 dist 9.58006 13.9868 9.18903 9.10984 7.84554 5.87173 11.8501 7.46176 10.5239 7.64658 15.1483 7.48005 12.6649 11.8736 5.79468 numMergedOcc 0
113 mol 259 unq 1 iso 5 dist 9.58006 13.9868 9.18903 11.8501 7.46176 10.5239 9.10984 7.84554 5.87173 7.64658 15.1483 7.48005 12.6649 5.79468 11.8736 numMergedOcc 0
114 mol 282 unq 0 iso 0 dist 5.67266 9.63727 8.04483 4.58403 8.76532 10.0156 5.04235 6.33524 5.39891 4.66602 5.41716 8.8673 10.1236 8.14825 7.36881 numMergedOcc 0
115 mol 282 unq 0 iso 1 dist 5.67266 9.63727 8.04483 5.04235 6.33524 5.39891 4.58403 8.76532 10.0156 4.66602 5.41716 8.8673 10.1236 7.36881 8.14825 numMergedOcc 0
116 mol 282 unq 0 iso 2 dist 5.67266 4.58403 8.76532 9.63727 8.04483 10.0156 5.04235 6.33524 4.66602 5.39891 5.41716 8.8673 8.14825 10.1236 7.36881 numMergedOcc 0
117 mol 282 unq 0 iso 3 dist 5.67266 4.58403 8.76532 5.04235 6.33524 4.66602 9.63727 8.04483 10.0156 5.39891 5.41716 8.8673 8.14825 7.36881 10.1236 numMergedOcc 0
118 mol 282 unq 0 iso 4 dist 5.67266 5.04235 6.33524 9.63727 8.04483 5.39891 4.58403 8.76532 4.66602 10.0156 5.41716 8.8673 7.36881 10.1236 8.14825 numMergedOcc 0
119 mol 282 unq 0 iso 5 dist 5.67266 5.04235 6.33524 4.58403 8.76532 4.66602 9.63727 8.04483 5.39891 10.0156 5.41716 8.8673 7.36881 8.14825 10.1236 numMergedOcc 0
120 mol 282 unq 1 iso 0 dist 5.80981 9.60898 8.04483 10.5698 8.76532 10.0156 8.37652 6.33524 5.39891 4.66602 5.37323 8.8673 10.1236 8.14825 7.36881 numMergedOcc 0
121 mol 282 unq 1 iso 1 dist 5.80981 9.60898 8.04483 8.37652 6.33524 5.39891 10.5698 8.76532 10.0156 4.66602 5.37323 8.8673 10.1236 7.36881 8.14825 numMergedOcc 0
122 mol 282 unq 1 iso 2 dist 5.80981 10.5698 8.76532 9.60898 8.04483 10.0156 8.37652 6.33524 4.66602 5.39891 5.37323 8.8673 8.14825 10.1236 7.36881 numMergedOcc 0
123 mol 282 unq 1 iso 3 dist 5.80981 10.5698 8.76532 8.37652 6.33524 4.66602 9.60898 8.04483 10.0156 5.39891 5.37323 8.8673 8.14825 7.36881 10.1236 numMergedOcc 0
124 mol 282 unq 1 iso 4 dist 5.80981 8.37652 6.33524 9.60898 8.04483 5.39891 10.5698 8.76532 4.66602 10.0156 5.37323 8.8673 7.36881 10.1236 8.14825 numMergedOcc 0
125 mol 282 unq 1 iso 5 dist 5.80981 8.37652 6.33524 10.5698 8.76532 4.66602 9.60898 8.04483 5.39891 10.0156 5.37323 8.8673 7.36881 8.14825 10.1236 numMergedOcc 0
126 mol 282 unq 2 iso 0 dist 9.63346 4.85461 8.04483 13.108 8.76532 10.0156 8.85797 6.33524 5.39891 4.66602 14.5422 8.8673 10.1236 8.14825 7.36881 numMergedOcc 0
127 mol 282 unq 2 iso 1 dist 9.63346 4.85461 8.04483 8.85797 6.33524 5.39891 13.108 8.76532 10.0156 4.66602 14.5422 8.8673 10.1236 7.36881 8.14825 numMergedOcc 0
128 mol 282 unq 2 iso 2 dist 9.63346 13.108 8.76532 4.85461 8.04483 10.0156 8.85797 6.33524 4.66602 5.39891 14.5422 8.8673 8.14825 10.1236 7.36881 numMergedOcc 0
129 mol 282 unq 2 iso 3 dist 9.63346 13.108 8.76532 8.85797 6.33524 4.66602 4.85461 8.04483 10.0156 5.39891 14.5422 8.8673 8.14825 7.36881 10.1236 numMergedOcc 0
130 mol 282 unq 2 iso 4 dist 9.63346 8.85797 6.33524 4.85461 8.04483 5.39891 13.108 8.76532 4.66602 10.0156 14.5422 8.8673 7.36881 10.1236 8.14825 numMergedOcc 0
131 mol 282 unq 2 iso 5 dist 9.63346 8.85797 6.33524 13.108 8.76532 4.66602 4.85461 8.04483 5.39891 10.0156 14.5422 8.8673 7.36881 8.14825 10.1236 numMergedOcc 0
