0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 9.68596 14.7759 13.0969 10.2446 7.88043 7.45262 11.024 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 6.36911 6.06176 9.68596 14.7759 13.0969 12.3097 8.80762 6.96586 15.0497 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 6.33889 11.4878 9.62394 9.5997 6.0397 11.0722 8.83269 9.82483 8.076 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 7.33768 4.32034 5.90981 6.00575 6.60423 8.62284 9.69752 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.86014 9.75144 5.39241 9.01567 8.67951 13.2265 6.00575 6.60423 8.62284 12.7806 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 6.86014 9.75144 5.39241 7.29868 8.52463 13.719 6.00575 6.60423 8.62284 9.36461 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 6.86465 8.63333 6.47744 9.92355 5.78774 12.0055 6.89191 10.5365 7.93481 15.5278 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 6.35756 8.89374 6.47744 7.68678 5.78774 12.0055 11.0355 10.5365 7.93481 15.5278 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 6.18601 8.43904 10.3457 6.73586 5.13589 7.39626 10.326 14.6439 9.87025 14.7366 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 5.98885 7.20046 5.4601 9.72611 5.6044 9.87435 5.93488 6.51749 7.345 7.11785 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 5.98885 7.20046 5.4601 7.99195 6.6251 4.69841 5.93488 6.51749 7.345 10.8541 numMergedOcc 0
11 mol 181 unq 2 iso 0 dist 5.98885 7.13543 10.0524 9.72611 5.6044 14.6648 5.93488 6.51749 9.52987 7.11785 numMergedOcc 0
12 mol 181 unq 3 iso 0 dist 5.98885 7.13543 10.0524 7.99195 6.6251 7.23063 5.93488 6.51749 9.52987 10.8541 numMergedOcc 0
13 mol 181 unq 4 iso 0 dist 9.09537 7.20046 6.14208 9.72611 12.9468 9.87435 5.93488 7.20392 7.345 7.11785 numMergedOcc 0
14 mol 181 unq 5 iso 0 dist 9.09537 7.20046 6.14208 7.99195 10.09 4.69841 5.93488 7.20392 7.345 10.8541 numMergedOcc 0
15 mol 181 unq 6 iso 0 dist 9.09537 7.13543 5.95965 9.72611 12.9468 14.6648 5.93488 7.20392 9.52987 7.11785 numMergedOcc 0
16 mol 181 unq 7 iso 0 dist 9.09537 7.13543 5.95965 7.99195 10.09 7.23063 5.93488 7.20392 9.52987 10.8541 numMergedOcc 0
17 mol 181 unq 8 iso 0 dist 7.81386 7.98142 9.53462 5.94469 7.77758 8.93991 9.92777 14.3453 5.49808 12.1214 numMergedOcc 0
18 mol 181 unq 9 iso 0 dist 7.81386 7.37327 11.1462 5.94469 7.77758 5.35588 9.92777 14.3453 7.96291 12.1214 numMergedOcc 0
19 mol 181 unq 10 iso 0 dist 7.63312 7.98142 9.60512 5.94469 12.5387 8.93991 9.92777 11.6558 5.49808 12.1214 numMergedOcc 0
20 mol 181 unq 11 iso 0 dist 7.63312 7.37327 13.3389 5.94469 12.5387 5.35588 9.92777 11.6558 7.96291 12.1214 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 8.56633 8.99696 9.82139 7.50013 8.46623 11.1666 15.4462 19.1226 9.71865 19.4436 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 8.56633 8.99696 9.82139 5.81233 10.7305 13.3562 15.4462 19.1226 9.71865 20.1545 numMergedOcc 0
23 mol 197 unq 2 iso 0 dist 8.56633 8.99696 9.82139 6.92924 5.41996 4.59269 15.4462 19.1226 9.71865 13.7066 numMergedOcc 0
24 mol 197 unq 3 iso 0 dist 8.56633 8.99696 9.82139 7.14306 6.64537 12.9766 15.4462 19.1226 9.71865 20.4054 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 6.03031 9.19704 8.66809 6.03688 8.15057 14.6029 5.54129 10.8209 9.83885 9.90954 numMergedOcc 0
26 mol 205 unq 1 iso 0 dist 6.03031 9.19704 8.66809 6.03688 8.15057 14.6029 5.28092 8.44861 5.42696 11.2584 numMergedOcc 0
27 mol 205 unq 2 iso 0 dist 7.26832 9.19704 6.23291 6.03688 12.4957 14.6029 5.54129 10.0424 9.83885 9.90954 numMergedOcc 0
28 mol 205 unq 3 iso 0 dist 7.26832 9.19704 6.23291 6.03688 12.4957 14.6029 5.28092 5.60393 5.42696 11.2584 numMergedOcc 0
29 mol 205 unq 4 iso 0 dist 7.80463 9.19704 13.231 6.03688 6.09749 14.6029 5.54129 10.03 9.83885 9.90954 numMergedOcc 0
30 mol 205 unq 5 iso 0 dist 7.80463 9.19704 13.231 6.03688 6.09749 14.6029 5.28092 11.3521 5.42696 11.2584 numMergedOcc 0
31 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 9.55668 7.60081 13.128 15.0089 17.7022 9.31673 19.7823 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 5.72887 9.29858 13.069 9.24557 14.7883 10.3809 10.7551 11.2809 9.47845 14.4327 numMergedOcc 0
33 mol 239 unq 0 iso 0 dist 7.00034 7.39747 6.26168 9.01021 10.0842 5.2908 5.66732 10.2163 7.18771 5.0804 numMergedOcc 0
34 mol 239 unq 1 iso 0 dist 7.00034 8.1777 5.39146 9.01021 10.0842 5.91881 5.66732 10.2163 7.94894 5.0804 numMergedOcc 0
35 mol 264 unq 0 iso 0 dist 9.361 9.5784 9.85579 7.16853 11.1431 13.9064 8.45726 13.6446 6.5422 14.6255 numMergedOcc 0
36 mol 264 unq 1 iso 0 dist 6.24356 9.5784 9.67998 7.16853 5.00209 13.9064 8.45726 11.0622 6.5422 14.6255 numMergedOcc 0
37 mol 278 unq 0 iso 0 dist 8.44326 6.35287 6.07447 8.00673 4.97614 7.83538 6.54009 10.8604 9.48589 7.21972 numMergedOcc 0
