0 mol 7 unq 0 iso 0 dist 6.7985 8.43473 6.14469 13.2603 13.0969 9.97624 13.6105 10.3333 5.5683 8.81608 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.68596 5.03847 6.14469 6.36911 13.0969 9.97624 6.88805 10.3333 5.5683 8.81608 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 5.89412 9.75966 6.03257 9.29358 6.19131 6.50647 6.91314 6.23015 5.20798 9.51568 numMergedOcc 0
3 mol 15 unq 1 iso 0 dist 7.07399 4.39605 6.03257 10.2062 6.19131 6.50647 5.49251 6.23015 5.20798 9.51568 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.87757 13.9331 8.88938 9.43699 6.06874 6.63839 13.6145 6.53269 5.38592 8.53931 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 8.50222 10.5328 8.88938 12.8446 6.06874 6.63839 5.18617 6.53269 5.38592 8.53931 numMergedOcc 0
6 mol 25 unq 2 iso 0 dist 7.55264 10.4337 8.88938 11.7303 6.06874 6.63839 5.68041 6.53269 5.38592 8.53931 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.65501 7.06961 6.88901 10.417 5.71029 6.0129 10.4782 8.46823 3.92737 4.44979 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 6.65501 7.06961 6.88901 10.417 5.71029 6.0129 3.9764 4.62494 3.94967 6.61111 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.99399 7.45148 7.20249 10.5042 4.48922 7.26955 10.5082 9.6153 10.3622 6.55202 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 8.99399 7.45148 7.20249 10.5042 4.48922 7.26955 19.5769 12.1959 14.9264 9.08536 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.16242 12.131 8.95662 11.3058 11.5342 9.50664 13.0405 8.83732 6.24625 8.55349 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 5.87634 14.8102 8.95662 16.0613 11.5342 9.50664 13.7612 8.83732 6.24625 8.55349 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 5.83771 4.60632 6.40575 12.7291 10.6595 8.55616 15.5729 13.3808 11.5269 6.44575 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 5.83771 4.60632 6.40575 12.7291 10.6595 8.55616 10.6898 10.1824 6.93712 7.43401 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 7.80532 5.71679 6.40575 10.9685 10.6595 8.55616 15.9138 13.3808 11.5269 6.44575 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 7.80532 5.71679 6.40575 10.9685 10.6595 8.55616 12.3479 10.1824 6.93712 7.43401 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 8.65535 11.6598 6.1886 12.1599 11.8663 8.52969 11.8031 11.7017 7.41775 7.10155 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 8.65535 11.6598 6.1886 12.1599 11.8663 8.52969 13.9025 15.4857 11.4789 6.11135 numMergedOcc 0
19 mol 194 unq 2 iso 0 dist 6.72379 7.11753 6.38324 5.48258 4.26755 8.52969 4.66791 9.00322 7.41775 7.10155 numMergedOcc 0
20 mol 194 unq 3 iso 0 dist 6.72379 7.11753 6.38324 5.48258 4.26755 8.52969 5.97754 9.94082 11.4789 6.11135 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 8.94014 5.50308 5.92374 6.05141 11.5793 6.73446 5.27215 12.1725 10.3346 8.69525 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 7.02333 7.11984 5.92374 8.09066 11.5793 6.73446 6.13368 12.1725 10.3346 8.69525 numMergedOcc 0
23 mol 238 unq 2 iso 0 dist 8.67864 7.95232 5.92374 7.2766 11.5793 6.73446 10.0605 12.1725 10.3346 8.69525 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 8.52587 16.3619 9.16942 12.5979 4.60275 9.20749 16.9539 8.60027 5.39432 6.66172 numMergedOcc 0
25 mol 274 unq 1 iso 0 dist 6.39866 5.64601 9.16942 9.19234 4.60275 9.20749 8.87855 8.60027 5.39432 6.66172 numMergedOcc 0
