0 mol 6 unq 0 iso 0 dist 5.17382 11.7366 9.38351 9.09373 9.56016 14.255 5.56246 8.15992 16.6659 9.20957 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.1895 7.11101 8.09675 11.3011 7.69222 10.2047 5.18016 9.85386 11.1342 13.815 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.1895 7.11101 8.09675 11.3011 7.69222 10.2047 11.1255 4.8983 8.22845 11.9118 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 9.1895 7.11101 8.09675 12.1586 5.82056 10.8441 5.18016 9.85386 11.1342 13.7005 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 9.1895 7.11101 8.09675 12.1586 5.82056 10.8441 11.1255 4.8983 8.22845 10.0644 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 9.1895 7.11101 8.09675 17.1183 9.09115 15.2203 5.18016 9.85386 11.1342 17.9011 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 9.1895 7.11101 8.09675 17.1183 9.09115 15.2203 11.1255 4.8983 8.22845 12.1501 numMergedOcc 0
7 mol 73 unq 6 iso 0 dist 9.1895 7.91398 9.02753 11.3011 7.69222 14.0199 5.18016 9.85386 10.0544 13.815 numMergedOcc 0
8 mol 73 unq 7 iso 0 dist 9.1895 7.91398 9.02753 11.3011 7.69222 14.0199 11.1255 4.8983 6.96897 11.9118 numMergedOcc 0
9 mol 73 unq 8 iso 0 dist 9.1895 7.91398 9.02753 12.1586 5.82056 13.7625 5.18016 9.85386 10.0544 13.7005 numMergedOcc 0
10 mol 73 unq 9 iso 0 dist 9.1895 7.91398 9.02753 12.1586 5.82056 13.7625 11.1255 4.8983 6.96897 10.0644 numMergedOcc 0
11 mol 73 unq 10 iso 0 dist 9.1895 7.91398 9.02753 17.1183 9.09115 17.5374 5.18016 9.85386 10.0544 17.9011 numMergedOcc 0
12 mol 73 unq 11 iso 0 dist 9.1895 7.91398 9.02753 17.1183 9.09115 17.5374 11.1255 4.8983 6.96897 12.1501 numMergedOcc 0
13 mol 73 unq 12 iso 0 dist 4.65445 4.61913 8.09675 6.69364 7.69222 10.2047 8.99414 9.85386 11.1342 13.815 numMergedOcc 0
14 mol 73 unq 13 iso 0 dist 4.65445 4.61913 8.09675 6.69364 7.69222 10.2047 7.45035 4.8983 8.22845 11.9118 numMergedOcc 0
15 mol 73 unq 14 iso 0 dist 4.65445 4.61913 8.09675 7.01672 5.82056 10.8441 8.99414 9.85386 11.1342 13.7005 numMergedOcc 0
16 mol 73 unq 15 iso 0 dist 4.65445 4.61913 8.09675 7.01672 5.82056 10.8441 7.45035 4.8983 8.22845 10.0644 numMergedOcc 0
17 mol 73 unq 16 iso 0 dist 4.65445 4.61913 8.09675 11.8328 9.09115 15.2203 8.99414 9.85386 11.1342 17.9011 numMergedOcc 0
18 mol 73 unq 17 iso 0 dist 4.65445 4.61913 8.09675 11.8328 9.09115 15.2203 7.45035 4.8983 8.22845 12.1501 numMergedOcc 0
19 mol 73 unq 18 iso 0 dist 4.65445 7.50438 9.02753 6.69364 7.69222 14.0199 8.99414 9.85386 10.0544 13.815 numMergedOcc 0
20 mol 73 unq 19 iso 0 dist 4.65445 7.50438 9.02753 6.69364 7.69222 14.0199 7.45035 4.8983 6.96897 11.9118 numMergedOcc 0
21 mol 73 unq 20 iso 0 dist 4.65445 7.50438 9.02753 7.01672 5.82056 13.7625 8.99414 9.85386 10.0544 13.7005 numMergedOcc 0
22 mol 73 unq 21 iso 0 dist 4.65445 7.50438 9.02753 7.01672 5.82056 13.7625 7.45035 4.8983 6.96897 10.0644 numMergedOcc 0
23 mol 73 unq 22 iso 0 dist 4.65445 7.50438 9.02753 11.8328 9.09115 17.5374 8.99414 9.85386 10.0544 17.9011 numMergedOcc 0
24 mol 73 unq 23 iso 0 dist 4.65445 7.50438 9.02753 11.8328 9.09115 17.5374 7.45035 4.8983 6.96897 12.1501 numMergedOcc 0
25 mol 73 unq 24 iso 0 dist 9.5546 17.549 8.09675 14.1944 7.69222 10.2047 15.5364 9.85386 11.1342 13.815 numMergedOcc 0
26 mol 73 unq 25 iso 0 dist 9.5546 17.549 8.09675 14.1944 7.69222 10.2047 11.0072 4.8983 8.22845 11.9118 numMergedOcc 0
27 mol 73 unq 26 iso 0 dist 9.5546 17.549 8.09675 11.048 5.82056 10.8441 15.5364 9.85386 11.1342 13.7005 numMergedOcc 0
28 mol 73 unq 27 iso 0 dist 9.5546 17.549 8.09675 11.048 5.82056 10.8441 11.0072 4.8983 8.22845 10.0644 numMergedOcc 0
29 mol 73 unq 28 iso 0 dist 9.5546 17.549 8.09675 9.48562 9.09115 15.2203 15.5364 9.85386 11.1342 17.9011 numMergedOcc 0
30 mol 73 unq 29 iso 0 dist 9.5546 17.549 8.09675 9.48562 9.09115 15.2203 11.0072 4.8983 8.22845 12.1501 numMergedOcc 0
31 mol 73 unq 30 iso 0 dist 9.5546 17.2275 9.02753 14.1944 7.69222 14.0199 15.5364 9.85386 10.0544 13.815 numMergedOcc 0
32 mol 73 unq 31 iso 0 dist 9.5546 17.2275 9.02753 14.1944 7.69222 14.0199 11.0072 4.8983 6.96897 11.9118 numMergedOcc 0
33 mol 73 unq 32 iso 0 dist 9.5546 17.2275 9.02753 11.048 5.82056 13.7625 15.5364 9.85386 10.0544 13.7005 numMergedOcc 0
34 mol 73 unq 33 iso 0 dist 9.5546 17.2275 9.02753 11.048 5.82056 13.7625 11.0072 4.8983 6.96897 10.0644 numMergedOcc 0
35 mol 73 unq 34 iso 0 dist 9.5546 17.2275 9.02753 9.48562 9.09115 17.5374 15.5364 9.85386 10.0544 17.9011 numMergedOcc 0
36 mol 73 unq 35 iso 0 dist 9.5546 17.2275 9.02753 9.48562 9.09115 17.5374 11.0072 4.8983 6.96897 12.1501 numMergedOcc 0
37 mol 204 unq 0 iso 0 dist 8.23488 9.59177 8.40718 10.1203 5.81438 12.5259 11.6355 8.77524 16.6893 5.80328 numMergedOcc 0
38 mol 272 unq 0 iso 0 dist 8.19471 6.85744 7.38085 3.87541 5.38409 3.7218 9.43485 9.87477 3.64298 6.69425 numMergedOcc 0
39 mol 273 unq 0 iso 0 dist 9.15342 6.26943 9.80002 11.3883 8.66133 10.6534 10.4344 8.13393 14.1095 9.06868 numMergedOcc 0
40 mol 273 unq 1 iso 0 dist 9.15342 6.26943 9.80002 14.5112 6.95569 15.8245 10.4344 8.13393 14.1095 11.8515 numMergedOcc 0
41 mol 273 unq 2 iso 0 dist 9.15342 10.4247 6.73794 11.3883 8.66133 3.80794 10.4344 8.13393 10.5232 9.06868 numMergedOcc 0
42 mol 273 unq 3 iso 0 dist 9.15342 10.4247 6.73794 14.5112 6.95569 13.255 10.4344 8.13393 10.5232 11.8515 numMergedOcc 0
43 mol 277 unq 0 iso 0 dist 6.00002 6.97425 6.70414 15.5601 9.91103 12.2421 9.74668 4.1545 7.31817 5.9732 numMergedOcc 0
44 mol 277 unq 1 iso 0 dist 6.00002 6.97425 6.70414 15.5601 9.91103 12.2421 7.89714 4.25172 3.91224 8.61922 numMergedOcc 0
45 mol 277 unq 2 iso 0 dist 6.00002 6.97425 6.70414 12.9203 7.0603 10.9521 9.74668 4.1545 7.31817 3.79766 numMergedOcc 0
46 mol 277 unq 3 iso 0 dist 6.00002 6.97425 6.70414 12.9203 7.0603 10.9521 7.89714 4.25172 3.91224 7.07613 numMergedOcc 0
47 mol 277 unq 4 iso 0 dist 8.1715 7.39478 6.70414 14.7919 9.91103 12.2421 9.56182 4.1545 7.31817 5.9732 numMergedOcc 0
48 mol 277 unq 5 iso 0 dist 8.1715 7.39478 6.70414 14.7919 9.91103 12.2421 7.8548 4.25172 3.91224 8.61922 numMergedOcc 0
49 mol 277 unq 6 iso 0 dist 8.1715 7.39478 6.70414 12.996 7.0603 10.9521 9.56182 4.1545 7.31817 3.79766 numMergedOcc 0
50 mol 277 unq 7 iso 0 dist 8.1715 7.39478 6.70414 12.996 7.0603 10.9521 7.8548 4.25172 3.91224 7.07613 numMergedOcc 0
51 mol 285 unq 0 iso 0 dist 6.71883 4.82304 5.76796 10.3055 5.49829 9.11313 13.2048 7.08681 10.1123 8.34667 numMergedOcc 0
52 mol 285 unq 1 iso 0 dist 6.71883 4.82304 5.76796 10.3055 5.49829 9.11313 4.0507 4.95596 7.01472 8.31211 numMergedOcc 0
53 mol 285 unq 2 iso 0 dist 6.71883 4.82304 5.76796 10.3055 5.49829 9.11313 8.91965 6.3508 11.0045 8.08247 numMergedOcc 0
54 mol 285 unq 3 iso 0 dist 6.71883 4.82304 5.76796 10.3055 5.49829 9.11313 7.14533 8.3005 8.2602 7.23311 numMergedOcc 0
55 mol 285 unq 4 iso 0 dist 6.71883 4.82304 5.76796 10.2133 6.24134 6.01574 13.2048 7.08681 10.1123 4.98469 numMergedOcc 0
56 mol 285 unq 5 iso 0 dist 6.71883 4.82304 5.76796 10.2133 6.24134 6.01574 4.0507 4.95596 7.01472 10.5542 numMergedOcc 0
57 mol 285 unq 6 iso 0 dist 6.71883 4.82304 5.76796 10.2133 6.24134 6.01574 8.91965 6.3508 11.0045 12.5361 numMergedOcc 0
58 mol 285 unq 7 iso 0 dist 6.71883 4.82304 5.76796 10.2133 6.24134 6.01574 7.14533 8.3005 8.2602 11.9464 numMergedOcc 0
59 mol 287 unq 0 iso 0 dist 9.2745 3.81488 7.47179 11.3536 6.06665 9.23896 9.17126 8.73403 5.42266 8.63376 numMergedOcc 0
60 mol 288 unq 0 iso 0 dist 9.2745 3.81488 7.47179 11.3536 6.06665 9.23896 9.17126 8.73403 5.42266 8.63376 numMergedOcc 0
61 mol 289 unq 0 iso 0 dist 9.2745 3.81488 7.47179 11.3536 6.06665 9.23896 9.17126 8.73403 5.42266 8.63376 numMergedOcc 0
